data_2lp8_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 2lp8 _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 ' 3' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 . . . . . 0 N--CA 1.468 0.437 0 N-CA-C 112.137 0.421 . . . . 2.7599999999999998 112.137 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.2 m -65.17 -18.05 64.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.833 0.349 . . . . 1.54 110.815 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.551 ' HB2' HD13 ' A' ' 134' ' ' LEU . 4.9 p30 -59.0 -27.25 65.25 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.055 -0.521 . . . . 1.78 111.01 173.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.621 ' O ' HG21 ' A' ' 10' ' ' VAL . 8.7 tpp85 -58.93 -47.76 83.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.814 -0.63 . . . . 1.8999999999999999 110.278 177.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -54.46 -47.71 72.6 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 115.316 -0.857 . . . . 0.68000000000000005 110.867 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.41 ' CD2' HG23 ' A' ' 46' ' ' VAL . 6.2 mt -57.77 -40.16 79.14 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.5 -1.227 . . . . 1.8 109.814 -173.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.4 t -67.53 -59.68 3.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.552 -0.749 . . . . 1.0700000000000001 110.196 174.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.621 HG21 ' O ' ' A' ' 6' ' ' ARG . 63.4 t -53.6 -50.86 47.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.117 -0.947 . . . . 1.1299999999999999 112.633 -174.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.6 -37.21 70.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.872 0.367 . . . . 0.58999999999999997 110.876 -176.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.693 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 35.3 t80 -73.6 -47.18 42.31 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 116.297 -0.41 . . . . 2.02 110.793 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.862 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.7 mp -59.13 -38.04 78.67 Favored 'General case' 0 C--O 1.228 -0.075 0 C-N-CA 120.249 -0.58 . . . . 1.0600000000000001 109.797 178.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.413 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 26.3 m -55.27 -50.42 69.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 1.6000000000000001 110.853 175.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -64.62 -32.06 73.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.003 -0.544 . . . . 1.49 110.461 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.603 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 7.6 mmpt? -63.94 -43.99 94.21 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 115.974 -0.557 . . . . 1.8400000000000001 111.353 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.625 HD21 ' O ' ' A' ' 13' ' ' LEU . 0.4 OUTLIER -71.55 -30.2 65.61 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 120.178 -0.609 . . . . 1.98 110.079 178.633 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.6 t -60.81 -40.23 91.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.638 -0.71 . . . . 1.3799999999999999 111.24 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -78.91 0.3 27.9 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.959 0.409 . . . . 1.51 112.014 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.679 ' HE2' HG13 ' A' ' 112' ' ' VAL . 19.0 mmmt -111.6 -27.08 8.71 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.899 0.857 . . . . 2.6499999999999999 109.123 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.79 20.29 11.87 Favored Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 114.097 -1.411 . . . . 0.54000000000000004 111.663 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -108.18 167.38 10.05 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.37 -0.604 . . . . 1.1200000000000001 109.37 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.425 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 3.9 t -110.42 144.42 39.24 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 121.084 0.468 . . . . 0.75 110.359 176.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.452 ' O ' ' HB3' ' A' ' 28' ' ' SER . 0.8 OUTLIER -74.44 -48.36 28.0 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.53 -0.759 . . . . 4.29 109.787 175.06 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.449 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 2.5 p -66.19 -31.46 72.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.035 -0.53 . . . . 1.8600000000000001 111.92 -173.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.425 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 89.9 mt-30 -61.71 -25.33 67.36 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.259 0.552 . . . . 1.52 111.148 177.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -121.35 17.64 11.42 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.559 -0.746 . . . . 1.53 111.058 -176.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.551 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 54.1 p -100.24 -178.13 3.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.484 0.659 . . . . 2.04 112.415 -171.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.613 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 6.7 t70 -171.97 -23.81 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.378 -1.283 . . . . 2.3100000000000001 109.069 -178.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.65 HG23 ' H ' ' A' ' 31' ' ' GLU . 7.1 m -47.17 -70.83 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 114.274 -1.33 . . . . 1.4099999999999999 112.643 -174.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.65 ' H ' HG23 ' A' ' 30' ' ' VAL . 8.7 pt-20 -100.6 1.16 40.5 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.53 0.681 . . . . 2.7400000000000002 109.245 175.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.613 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 31.1 tt0 . . . . . 0 N--CA 1.45 -0.455 0 CA-C-N 114.814 -1.085 . . . . 1.45 110.894 -176.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.806 HG21 ' H ' ' A' ' 42' ' ' GLU . 0.8 OUTLIER . . . . . 0 CA--C 1.535 0.372 0 CA-C-O 120.602 0.239 . . . . 1.45 110.488 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.806 ' H ' HG21 ' A' ' 41' ' ' THR . 15.2 pt-20 -93.68 -31.94 14.25 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 122.343 1.068 . . . . 2.02 108.935 170.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.892 ' HA ' HG13 ' A' ' 46' ' ' VAL . 66.6 m -59.17 -25.91 64.33 Favored 'General case' 0 C--O 1.209 -1.027 0 CA-C-N 113.315 -1.766 . . . . 1.25 113.496 -170.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -43.96 -38.89 3.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 118.131 0.423 . . . . 1.9099999999999999 111.56 -177.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.06 -42.35 14.02 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.567 0.21 . . . . 1.1799999999999999 111.567 174.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.892 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.6 m -68.33 -41.92 83.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 120.908 -0.317 . . . . 2.0099999999999998 111.796 -175.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.785 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.0 ptpt -68.4 -36.26 78.85 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.154 -0.684 . . . . 1.3799999999999999 109.154 178.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.51 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 5.1 mm100 -61.16 -36.52 80.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.587 -0.733 . . . . 0.98999999999999999 111.405 174.064 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.569 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -75.7 -40.66 55.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.673 0.749 . . . . 1.1399999999999999 110.177 175.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.55 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -56.65 -40.71 75.94 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.722 -1.126 . . . . 1.95 112.113 -178.92 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 7.5 ptp180 -75.44 -29.89 59.84 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.774 0.797 . . . . 2.5099999999999998 109.617 -169.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 32.9 mm-40 -72.51 -48.3 41.63 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.283 -1.326 . . . . 1.1000000000000001 109.852 179.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.57 -36.99 85.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.557 -0.747 . . . . 1.04 110.355 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.572 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -61.89 -42.36 99.73 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.912 -0.585 . . . . 0.69999999999999996 111.782 176.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -58.64 -42.98 89.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.005 0.431 . . . . 1.04 110.517 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -57.41 -28.26 63.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.394 -0.821 . . . . 2.29 111.239 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.489 ' HD2' ' HB3' ' A' ' 105' ' ' SER . 17.2 t80 -82.2 -39.4 23.18 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.221 -0.445 . . . . 2.9300000000000002 110.983 178.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.687 ' HA ' ' CE2' ' A' ' 61' ' ' TYR . 40.2 mt-10 -60.52 -63.69 1.21 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.138 -0.483 . . . . 1.3 112.21 -168.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.598 HD11 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -49.64 -37.46 28.35 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 123.673 0.608 . . . . 2.1899999999999999 112.342 -178.399 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.598 ' H ' HD11 ' A' ' 59' ' ' LEU . 63.6 mtt180 -63.6 -44.54 93.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.172 -0.467 . . . . 3.1400000000000001 111.728 -177.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.687 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 5.5 p90 -90.95 -7.81 51.03 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 120.654 -0.418 . . . . 5.5899999999999999 111.506 -179.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -58.28 -26.0 62.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 4.9299999999999997 111.385 -174.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -55.87 -46.26 78.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.046 -0.525 . . . . 5.3499999999999996 110.937 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.689 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.85 -32.7 15.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.409 -0.36 . . . . 1.7 111.498 -178.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.68 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 47.5 t80 -42.91 -46.92 5.54 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.735 1.013 . . . . 3.52 113.735 -171.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.2 p -68.13 -27.53 66.52 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.92 0.391 . . . . 2.5899999999999999 111.608 -175.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -90.42 -29.21 18.14 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.023 -0.535 . . . . 2.7200000000000002 111.552 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.689 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 65.1 mt -66.48 -17.77 64.99 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.894 0.702 . . . . 2.25 112.894 -171.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.626 HG21 HG13 ' A' ' 74' ' ' ILE . 8.6 p -61.24 -24.77 66.6 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.429 0.633 . . . . 1.26 110.694 -176.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.0 m -74.95 -29.71 61.01 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.847 -1.069 . . . . 1.8 110.501 176.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.615 ' NE2' HD22 ' A' ' 68' ' ' LEU . 12.6 mt-30 -82.0 -49.47 10.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.475 -0.784 . . . . 1.8899999999999999 110.504 -177.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.685 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.7 mp -66.17 -28.77 69.03 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.086 -0.709 . . . . 1.98 109.086 176.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 67.9 t60 64.45 55.26 1.39 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 122.244 1.021 . . . . 3.54 108.253 -176.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.626 HG13 HG21 ' A' ' 69' ' ' THR . 15.5 mm -57.42 112.04 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 113.628 -1.624 . . . . 1.1499999999999999 110.666 -178.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.785 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.5 -167.45 0.16 Allowed Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 107.424 -1.324 . . . . 1.1200000000000001 107.424 -169.12 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.785 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.0 Cg_exo -29.03 165.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.303 0 C-N-CA 124.636 3.558 . . . . 0.53000000000000003 115.037 162.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -34.61 -24.63 0.01 OUTLIER Glycine 0 N--CA 1.474 1.208 0 N-CA-C 117.221 1.648 . . . . 0.40999999999999998 117.221 -171.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 76' ' ' PRO . 40.1 p -69.1 3.37 2.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 117.956 0.878 . . . . 1.22 112.096 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.11 -14.15 62.2 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.274 0.559 . . . . 1.0700000000000001 109.961 173.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -78.12 -15.82 58.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.567 . . . . 4.3099999999999996 109.543 176.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.48 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 36.5 mt-30 -87.87 -22.62 24.32 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.801 0.81 . . . . 1.03 109.672 173.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.517 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 5.8 m -72.35 -48.71 39.67 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.617 -1.174 . . . . 0.47999999999999998 109.293 170.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.408 ' O ' HG11 ' A' ' 86' ' ' VAL . 84.8 t80 -70.69 -15.59 62.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.021 -0.991 . . . . 1.4399999999999999 110.047 173.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.655 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.1 tt0 -64.7 -49.07 72.35 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.167 0.508 . . . . 0.80000000000000004 110.276 175.334 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -43.07 -44.8 5.02 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.525 -1.216 . . . . 1.99 111.318 178.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.944 ' HA ' ' HA2' ' B' 1005 ' ' GLY . 0.9 OUTLIER -86.15 -44.53 16.74 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.335 0 CA-C-N 113.835 -1.53 . . . . 1.8999999999999999 111.829 -172.645 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.655 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.8 p -62.23 -23.53 32.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.98 0.895 . . . . 1.4299999999999999 109.876 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.73 -48.52 74.31 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.357 -1.292 . . . . 0.91000000000000003 110.917 176.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.704 ' HB3' ' HB1' ' B' 1009 ' ' ALA . 5.6 mm-40 -69.15 -43.56 74.06 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-O 122.443 1.116 . . . . 2.8700000000000001 108.815 178.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.589 ' HG ' ' NH1' ' A' ' 99' ' ' ARG . 8.4 tp -54.86 -24.98 25.71 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 112.312 -2.222 . . . . 1.9199999999999999 111.518 -173.312 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.495 ' O ' HG22 ' A' ' 95' ' ' VAL . 76.1 t80 -100.04 -35.67 9.62 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.637 0.732 . . . . 2.9700000000000002 110.935 -173.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.526 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 7.5 ptm180 -77.82 -35.26 51.5 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.502 -0.772 . . . . 5.6699999999999999 111.42 -172.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -93.22 20.64 6.74 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.411 -0.813 . . . . 3.1200000000000001 112.753 -169.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.582 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 128.02 68.59 0.14 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 117.167 -2.444 . . . . 2.3100000000000001 115.935 174.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.548 HG23 HH21 ' A' ' 99' ' ' ARG . 67.8 t -73.31 98.43 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 118.649 1.225 . . . . 1.6799999999999999 111.611 177.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.409 ' ND2' ' N ' ' A' ' 96' ' ' ASN . 1.0 OUTLIER -112.45 -170.78 1.73 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.327 -1.306 . . . . 2.1200000000000001 108.996 179.582 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.752 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 22.5 m-90 -63.63 -63.54 1.14 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.9 0.381 . . . . 4.1200000000000001 110.666 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.411 ' O ' HG21 ' A' ' 101' ' ' VAL . . . -67.11 -26.66 73.35 Favored Glycine 0 C--O 1.225 -0.411 0 CA-C-N 115.933 -0.576 . . . . 0.80000000000000004 112.723 -177.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.608 ' HD2' ' O ' ' A' ' 99' ' ' ARG . 1.7 tmm_? -58.23 -40.16 80.95 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.936 0.398 . . . . 4.9100000000000001 110.268 178.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 52.6 mt -67.8 -28.18 40.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.522 -0.308 . . . . 1.1100000000000001 111.656 -175.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.447 ' O ' ' HD1' ' A' ' 104' ' ' PHE . 0.8 OUTLIER -64.03 -25.88 39.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.308 0.575 . . . . 2.0299999999999998 110.079 176.472 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.479 ' HA ' ' CD2' ' A' ' 57' ' ' PHE . . . -66.94 -39.79 87.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.735 0.779 . . . . 1.0600000000000001 110.327 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.442 ' HB2' HH12 ' A' ' 99' ' ' ARG . 28.0 t80 -64.0 -46.17 85.74 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.366 -1.288 . . . . 1.8400000000000001 110.914 -178.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.589 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.1 OUTLIER -80.36 -18.69 48.29 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.529 -0.468 . . . . 4.21 110.553 -178.283 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.693 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 35.3 t -75.17 -57.5 3.85 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.383 -0.371 . . . . 1.55 110.59 178.369 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -68.3 -24.19 64.82 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 109.498 -0.556 . . . . 3.6400000000000001 109.498 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.524 ' HA3' ' HE2' ' A' ' 130' ' ' MET . . . -67.12 -42.3 91.8 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.69 -0.767 . . . . 0.32000000000000001 111.467 172.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.862 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.82 -31.29 79.28 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.66 -0.781 . . . . 0.23999999999999999 111.396 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.68 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -75.2 -33.05 61.37 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.69 -0.255 . . . . 1.05 110.553 176.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.42 HD12 HD11 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -59.48 -39.4 83.62 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 107.956 -1.127 . . . . 1.78 107.956 179.173 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.733 ' SG ' HG21 ' A' ' 123' ' ' VAL . 29.9 t -49.57 -62.92 1.28 Allowed 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 113.368 -1.742 . . . . 0.90000000000000002 110.204 172.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.732 ' HA ' HG12 ' A' ' 115' ' ' VAL . 46.8 t -63.18 -34.54 67.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.384 -0.371 . . . . 1.2 111.48 -176.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.621 ' HB3' HG22 ' A' ' 74' ' ' ILE . 36.7 mt-10 -55.91 -25.32 42.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.097 0.475 . . . . 2.5099999999999998 110.418 176.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.429 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 65.0 m -85.0 -41.46 15.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.485 -0.931 . . . . 0.28000000000000003 108.485 -178.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.732 HG12 ' HA ' ' A' ' 112' ' ' VAL . 1.4 m -69.14 -29.74 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.349 0 CA-C-N 114.734 -1.121 . . . . 1.8300000000000001 109.422 -177.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -51.31 -51.03 58.01 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.205 -1.816 . . . . 0.59999999999999998 111.563 175.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.473 ' CG ' ' HE3' ' A' ' 119' ' ' MET . 13.2 mmtp -83.52 10.59 8.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.724 -0.671 . . . . 2.1600000000000001 109.743 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.588 ' HA ' ' NE2' ' A' ' 120' ' ' GLN . 36.0 mt-10 63.31 55.82 1.79 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 122.159 0.981 . . . . 1.8799999999999999 109.805 -176.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.473 ' HE3' ' CG ' ' A' ' 117' ' ' LYS . 24.6 mtm -134.96 37.36 3.04 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.848 -1.524 . . . . 1.0800000000000001 107.553 179.054 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.678 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 4.9 mp0 -52.28 -7.36 0.06 Allowed 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 114.903 -1.044 . . . . 1.1499999999999999 113.353 -178.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.464 HG23 HD21 ' A' ' 122' ' ' LEU . 27.0 m -67.41 -22.41 28.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 121.464 -0.773 . . . . 1.1899999999999999 111.921 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.698 HD11 ' HD2' ' A' ' 125' ' ' ARG . 3.5 mm? -71.6 -24.77 61.95 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.014 0.435 . . . . 1.0600000000000001 109.928 178.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.733 HG21 ' SG ' ' A' ' 111' ' ' CYS . 42.3 t -44.92 -49.38 2.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 114.716 -1.129 . . . . 1.0 112.593 -177.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.551 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 8.9 t -78.22 -34.83 49.07 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.44 -0.504 . . . . 1.6599999999999999 110.58 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.698 ' HD2' HD11 ' A' ' 122' ' ' LEU . 66.5 mtt180 -62.85 -49.27 75.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.002 -0.545 . . . . 3.2999999999999998 110.418 -176.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.56 HD12 ' HA ' ' A' ' 111' ' ' CYS . 73.6 mt -57.82 -52.19 60.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.488 -0.778 . . . . 1.0600000000000001 110.767 178.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.746 ' HB1' HD21 ' A' ' 13' ' ' LEU . . . -54.07 -36.68 63.4 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 123.291 0.37 . . . . 1.1000000000000001 111.339 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.46 -56.13 23.54 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.357 0.599 . . . . 1.1200000000000001 111.054 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -72.57 -23.7 61.0 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.225 -0.898 . . . . 4.7699999999999996 111.627 -174.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.543 ' SD ' HG22 ' A' ' 126' ' ' ILE . 88.8 mtp -66.01 -58.72 4.87 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.1 0.476 . . . . 1.0900000000000001 110.343 174.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.96 -35.65 79.09 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.704 -0.68 . . . . 1.05 110.702 -178.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.6 m -63.47 -46.7 84.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.411 -0.359 . . . . 1.1299999999999999 110.95 176.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -56.69 -39.12 73.25 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.858 -0.423 . . . . 3.3500000000000001 109.858 177.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.931 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.9 tt -62.77 -50.98 68.9 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.985 -0.746 . . . . 1.5900000000000001 108.985 174.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -51.46 -49.54 61.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.673 0.62 . . . . 0.46000000000000002 112.673 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -83.15 -51.29 7.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.041 0.448 . . . . 0.58999999999999997 112.103 -176.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -91.4 -50.46 5.79 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 113.121 0.786 . . . . 2.3399999999999999 113.121 -170.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.931 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -80.61 -45.05 17.93 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.564 0.95 . . . . 1.8999999999999999 113.564 -168.323 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.656 ' HA ' HD13 ' A' ' 142' ' ' ILE . 28.1 tt0 -47.47 -50.4 49.82 Favored Pre-proline 0 C--N 1.322 -0.612 0 O-C-N 123.686 0.616 . . . . 0.75 112.526 -175.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.555 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 51.8 Cg_exo -52.99 -50.26 14.69 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 121.746 1.63 . . . . 0.87 111.734 176.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -58.83 -48.16 82.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.587 -0.733 . . . . 1.4299999999999999 110.513 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.656 HD13 ' HA ' ' A' ' 139' ' ' GLU . 43.9 mt -49.92 -50.96 17.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.058 -0.519 . . . . 1.1299999999999999 111.351 176.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.57 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 79.2 mm-40 -60.21 -31.45 70.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.559 -0.746 . . . . 0.57999999999999996 111.587 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.7 mm-40 -65.41 -20.71 66.49 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 121.519 0.676 . . . . 0.78000000000000003 110.685 177.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.403 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 18.1 m-80 -111.47 5.84 19.83 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.088 -0.96 . . . . 0.93000000000000005 110.371 -174.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.01 -47.08 1.06 Allowed Glycine 0 N--CA 1.441 -1.006 0 CA-C-N 115.318 -0.855 . . . . 0.56000000000000005 113.294 173.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . 0.542 ' HA2' HG21 ' A' ' 142' ' ' ILE . . . 130.16 -172.39 20.24 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.48 -0.867 . . . . 0.48999999999999999 112.064 -177.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 9.0 m-90 -76.08 -35.5 59.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.529 0.204 . . . . 4.5199999999999996 110.742 -177.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -59.1 -43.94 91.91 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.176 0.512 . . . . 1.96 109.702 175.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.575 ' O ' HD12 ' A' ' 154' ' ' LEU . 95.8 m -60.1 -34.48 73.54 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.29 -0.868 . . . . 1.24 111.021 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.752 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 90.0 t80 -60.68 -41.44 95.09 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.482 -0.487 . . . . 3.7200000000000002 110.212 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.541 HG11 ' HA ' ' A' ' 46' ' ' VAL . 1.5 m -76.03 -26.94 17.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.916 0.389 . . . . 1.8600000000000001 110.486 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 150' ' ' THR . 7.8 mm-40 -56.0 -47.95 76.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.342 0.592 . . . . 1.6699999999999999 109.56 170.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.575 HD12 ' O ' ' A' ' 150' ' ' THR . 7.4 mp -78.25 -61.25 2.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.2 -0.909 . . . . 1.96 112.902 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -120.83 29.64 7.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.303 0.573 . . . . 4.3899999999999997 110.423 -168.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.569 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -58.92 166.19 7.89 Favored Glycine 0 CA--C 1.506 -0.473 0 CA-C-N 115.476 -0.784 . . . . 1.1000000000000001 114.115 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . 0.456 ' ND2' HE21 ' A' ' 48' ' ' GLN . 26.9 t-20 . . . . . 0 C--N 1.314 -0.97 0 CA-C-N 113.835 -1.182 . . . . 1.29 111.038 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1005 ' ' GLY . . . . . 0.944 ' HA2' ' HA ' ' A' ' 86' ' ' VAL . . . . . . . . 0 N--CA 1.435 -1.405 0 N-CA-C 110.287 -1.125 . . . . 1.26 110.287 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -61.08 -42.16 97.99 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.932 0.345 . . . . 3.4500000000000002 111.932 177.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -70.91 -49.5 45.1 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.342 0.497 . . . . 1.54 112.342 -171.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.599 ' HB2' HG23 ' A' ' 86' ' ' VAL . 2.1 mm? -73.82 -34.93 64.78 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.055 -0.258 . . . . 1.8999999999999999 110.425 -178.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 0.704 ' HB1' ' HB3' ' A' ' 89' ' ' GLU . . . -47.22 -47.52 24.47 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.983 0.897 . . . . 1.45 110.377 168.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -79.82 -58.42 3.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 114.026 -1.443 . . . . 1.51 111.881 -174.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -61.65 -19.21 62.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 2.0699999999999998 111.15 -178.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.92 -25.08 72.52 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 121.033 -0.603 . . . . 0.80000000000000004 113.106 -178.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 31.1 t70 -77.05 5.83 7.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.411 0.624 . . . . 1.8999999999999999 110.513 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 35.3 m . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.028 -0.533 . . . . 1.4399999999999999 111.092 -178.69 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.423 ' O ' ' HB3' ' A' ' 6' ' ' ARG . 24.3 mp0 . . . . . 0 CA--C 1.522 -0.107 0 CA-C-O 121.021 0.439 . . . . 2.7599999999999998 110.651 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.528 ' O ' ' HG ' ' A' ' 8' ' ' LEU . 5.1 p -68.7 -32.2 71.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.095 -0.502 . . . . 1.54 111.176 178.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.687 ' HA ' HD12 ' A' ' 8' ' ' LEU . 50.6 m-20 -62.15 -26.66 68.45 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.077 0.465 . . . . 1.78 110.127 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.594 ' O ' HG23 ' A' ' 10' ' ' VAL . 16.9 tpp85 -57.47 -49.36 76.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.491 -0.777 . . . . 1.8999999999999999 109.81 176.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.59 ' CD ' ' HG ' ' A' ' 43' ' ' SER . 45.0 mt-10 -57.23 -44.99 84.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.528 -0.76 . . . . 0.68000000000000005 111.085 178.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.687 HD12 ' HA ' ' A' ' 5' ' ' ASN . 8.8 mt -60.65 -29.39 69.24 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.583 -1.189 . . . . 1.8 110.117 -174.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.546 HG22 ' N ' ' A' ' 131' ' ' ALA . 55.9 t -80.65 -59.62 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 115.05 -0.977 . . . . 1.0700000000000001 110.161 173.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 6' ' ' ARG . 99.4 t -52.28 -54.59 13.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.38 -0.827 . . . . 1.1299999999999999 112.466 -175.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -56.85 -35.86 69.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.996 0.427 . . . . 0.58999999999999997 110.355 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.513 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 8.2 t80 -72.38 -48.0 45.03 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.84 -0.618 . . . . 2.02 110.469 -178.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.824 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.5 mp -61.66 -42.21 98.6 Favored 'General case' 0 C--N 1.338 0.098 0 C-N-CA 120.793 -0.363 . . . . 1.0600000000000001 110.516 177.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.8 t -58.97 -45.52 90.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.12 -0.491 . . . . 1.6000000000000001 110.142 177.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -59.37 -33.83 71.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.469 -0.787 . . . . 1.49 110.936 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.672 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 8.6 mmpt? -75.96 -30.96 58.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.379 -0.373 . . . . 1.8400000000000001 111.932 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.541 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -70.25 -27.78 64.71 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.261 -0.576 . . . . 1.98 110.265 176.511 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -58.8 -43.41 90.54 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.879 -0.601 . . . . 1.3799999999999999 112.315 -178.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -72.45 -2.75 20.68 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.28 0.562 . . . . 1.51 111.551 -177.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.581 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 18.3 mmmt -109.64 -26.25 9.99 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.945 0.879 . . . . 2.6499999999999999 109.014 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.14 22.1 11.04 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 113.829 -1.532 . . . . 0.54000000000000004 111.171 178.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.581 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 95.1 m-85 -114.17 165.52 12.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.942 0.401 . . . . 1.1200000000000001 110.827 -179.036 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.8 t -110.92 141.33 44.48 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.758 -0.656 . . . . 0.75 109.906 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -65.72 -46.12 80.13 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.113 -0.494 . . . . 4.29 110.01 174.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.3 p -64.75 -36.52 84.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.748 -0.66 . . . . 1.8600000000000001 111.836 -172.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.69 -31.01 69.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.073 0.463 . . . . 1.52 111.24 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.527 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 15.8 m-85 -112.54 13.54 20.08 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.892 -0.594 . . . . 1.53 110.441 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.562 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 79.8 p -96.76 -179.29 4.53 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 121.69 0.757 . . . . 2.04 111.511 -176.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.511 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.2 t70 -164.86 -26.06 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.98 -1.464 . . . . 2.3100000000000001 107.753 -177.389 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.614 HG21 ' H ' ' A' ' 31' ' ' GLU . 8.9 m -59.81 -75.11 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 113.734 -1.575 . . . . 1.4099999999999999 112.331 -177.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.614 ' H ' HG21 ' A' ' 30' ' ' VAL . 12.3 mm-40 -80.72 -7.87 59.49 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.618 -0.882 . . . . 2.7400000000000002 108.618 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.511 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 25.2 tt0 . . . . . 0 N--CA 1.443 -0.792 0 CA-C-N 114.174 -1.376 . . . . 1.45 110.528 177.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.829 HG21 ' H ' ' A' ' 42' ' ' GLU . 1.3 t . . . . . 0 CA--C 1.54 0.569 0 CA-C-O 120.594 0.235 . . . . 1.45 110.725 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.829 ' H ' HG21 ' A' ' 41' ' ' THR . 15.9 pt-20 -95.56 -26.5 15.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.589 1.185 . . . . 2.02 108.762 167.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.755 ' HB2' ' HE3' ' A' ' 47' ' ' LYS . 1.4 p -55.78 -39.67 71.57 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 112.407 -2.179 . . . . 1.25 114.56 -169.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -39.66 -53.74 2.13 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.895 0.747 . . . . 1.9099999999999999 112.792 -169.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.15 -36.24 58.86 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.94 0.348 . . . . 1.1799999999999999 111.94 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.655 ' HB ' ' HB3' ' A' ' 148' ' ' TRP . 0.8 OUTLIER -69.98 -44.88 78.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 121.012 -0.275 . . . . 2.0099999999999998 110.888 -176.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.755 ' HE3' ' HB2' ' A' ' 43' ' ' SER . 18.1 ptpt -64.16 -41.28 97.22 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.422 -0.584 . . . . 1.3799999999999999 109.422 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.682 HE21 ' HA ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -56.89 -34.93 68.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.357 -0.838 . . . . 0.98999999999999999 111.545 174.296 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.703 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -78.61 -33.86 47.11 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.234 0.54 . . . . 1.1399999999999999 110.501 178.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 12.5 mt -63.38 -33.66 76.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.484 -0.78 . . . . 1.95 112.306 -177.165 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.649 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.3 ptp180 -79.49 -29.25 41.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.592 0.71 . . . . 2.5099999999999998 109.178 -174.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -70.27 -43.78 69.77 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.29 -1.323 . . . . 1.1000000000000001 110.655 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.28 -43.68 69.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.823 -0.626 . . . . 1.04 110.526 176.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.632 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.66 -39.09 96.1 Favored Glycine 0 C--O 1.226 -0.346 0 CA-C-N 115.852 -0.613 . . . . 0.69999999999999996 111.815 178.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -53.59 -43.58 68.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.024 0.44 . . . . 1.04 110.463 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.665 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 37.5 mt-10 -69.97 -38.4 76.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.891 -0.595 . . . . 2.29 111.268 177.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.52 ' HE2' ' CZ ' ' A' ' 106' ' ' PHE . 7.3 t80 -65.16 -33.0 74.98 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.363 -0.381 . . . . 2.9300000000000002 110.773 -174.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.632 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 33.6 mt-10 -65.35 -47.14 77.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.16 -0.473 . . . . 1.3 110.793 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.665 ' HG ' ' O ' ' A' ' 56' ' ' GLU . 4.6 pp -68.67 -31.26 70.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 2.1899999999999999 110.638 -179.28 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.694 ' HB3' ' SG ' ' B' 1014 ' ' CYS . 47.3 mtt180 -68.77 -35.94 77.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.586 0.708 . . . . 3.1400000000000001 110.186 178.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.683 ' HB3' ' HB3' ' A' ' 65' ' ' PHE . 0.2 OUTLIER -91.5 0.04 57.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.925 -1.034 . . . . 5.5899999999999999 112.089 -177.718 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -35.81 -39.44 0.15 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.125 1.158 . . . . 4.9299999999999997 114.125 -172.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 34.6 ttm180 -75.46 -42.98 51.9 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 122.181 -0.324 . . . . 5.3499999999999996 111.7 -175.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.532 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -91.91 -41.19 10.73 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.786 0.661 . . . . 1.7 112.786 -174.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.683 ' HB3' ' HB3' ' A' ' 61' ' ' TYR . 5.5 p90 -49.49 -40.71 38.39 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.524 0.935 . . . . 3.52 113.524 -164.12 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.5 t -91.03 -42.36 10.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.934 0.397 . . . . 2.5899999999999999 110.39 -177.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -59.2 -28.64 66.83 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.619 0.723 . . . . 2.7200000000000002 110.955 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.647 ' O ' HD12 ' A' ' 72' ' ' LEU . 1.8 mp -62.42 -17.06 58.41 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.029 -0.987 . . . . 2.25 113.263 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.725 HG22 HG13 ' A' ' 74' ' ' ILE . 12.6 p -62.65 -22.9 66.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 118.397 0.544 . . . . 1.26 112.058 -175.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.7 t -76.15 -35.14 59.35 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.017 -0.735 . . . . 1.8 109.017 174.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.494 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 9.0 mt-30 -69.2 -47.41 64.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.816 -1.084 . . . . 1.8899999999999999 109.785 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.647 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mt -70.53 -32.02 69.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.602 -0.726 . . . . 1.98 110.109 177.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 60.74 63.95 1.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.999 0.904 . . . . 3.54 108.861 -172.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.725 HG13 HG22 ' A' ' 69' ' ' THR . 29.3 mm -60.64 115.05 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 114.006 -1.452 . . . . 1.1499999999999999 111.382 -178.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.773 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -155.58 -172.26 0.31 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 107.963 -1.125 . . . . 1.1200000000000001 107.963 -171.463 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.773 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 17.8 Cg_exo -31.05 167.36 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.327 0 C-N-CA 125.029 3.819 . . . . 0.53000000000000003 115.091 165.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.487 ' N ' HD12 ' A' ' 122' ' ' LEU . . . -29.85 -27.16 0.01 OUTLIER Glycine 0 N--CA 1.476 1.331 0 N-CA-C 117.372 1.709 . . . . 0.40999999999999998 117.372 -174.176 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.458 ' N ' ' O ' ' A' ' 76' ' ' PRO . 24.9 p -68.48 -0.36 4.92 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 117.909 0.855 . . . . 1.22 111.925 177.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.32 -14.75 62.72 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.295 0.569 . . . . 1.0700000000000001 109.621 170.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -73.33 -25.99 60.85 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.577 -0.738 . . . . 4.3099999999999996 109.553 173.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.43 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 78.2 mt-30 -80.71 -31.98 35.94 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.902 0.858 . . . . 1.03 109.092 177.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.3 m -63.62 -54.21 39.43 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.015 -1.448 . . . . 0.47999999999999998 110.005 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.54 ' HA ' HG23 ' A' ' 86' ' ' VAL . 79.7 t80 -70.41 -18.49 63.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.365 -0.834 . . . . 1.4399999999999999 110.717 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.596 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.6 tt0 -59.21 -50.25 74.76 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.692 -0.686 . . . . 0.80000000000000004 110.46 176.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.47 ' O ' ' HG2' ' A' ' 89' ' ' GLU . 80.5 mt-30 -47.62 -32.45 5.57 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.596 -1.184 . . . . 1.99 110.769 175.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 1.019 HG12 ' HG ' ' B' 1008 ' ' LEU . 1.6 t -84.1 -54.7 8.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-N 114.552 -1.203 . . . . 1.8999999999999999 110.879 -176.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.596 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.3 p -60.69 -29.65 45.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.83 -0.623 . . . . 1.4299999999999999 109.989 -176.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.72 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 0.7 OUTLIER -58.22 -50.09 74.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.758 -1.11 . . . . 0.91000000000000003 110.687 175.929 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 1.004 ' HB3' ' HB2' ' B' 1009 ' ' ALA . 35.7 mm-40 -64.26 -42.79 96.32 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 122.331 1.062 . . . . 2.8700000000000001 109.391 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.519 HD11 ' HA ' ' A' ' 90' ' ' LEU . 0.3 OUTLIER -58.14 -25.48 61.49 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 112.692 -2.049 . . . . 1.9199999999999999 112.814 -165.906 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.581 ' HA ' HG22 ' A' ' 95' ' ' VAL . 15.9 p90 -106.28 -22.15 12.91 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.62 -0.432 . . . . 2.9700000000000002 112.071 -174.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.72 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.7 OUTLIER -94.24 -29.59 15.01 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-O 121.257 0.551 . . . . 5.6699999999999999 111.298 -175.557 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.551 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 37.6 t70 -90.31 7.48 38.19 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.637 -0.71 . . . . 3.1200000000000001 112.685 -168.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 129.59 70.63 0.12 Allowed Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 117.125 -2.464 . . . . 2.3100000000000001 114.345 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.581 HG22 ' HA ' ' A' ' 91' ' ' PHE . 48.6 t -71.65 101.52 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 122.399 1.095 . . . . 1.6799999999999999 111.302 -179.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.411 ' H ' ' CB ' ' A' ' 99' ' ' ARG . 0.7 OUTLIER -111.47 -179.87 3.83 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 113.745 -1.57 . . . . 2.1200000000000001 108.293 177.877 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.573 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 5.1 m95 -60.93 -52.43 65.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.81 0.338 . . . . 4.1200000000000001 111.002 177.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.88 -20.0 75.69 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.926 -0.654 . . . . 0.80000000000000004 112.697 -179.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.411 ' CB ' ' H ' ' A' ' 96' ' ' ASN . 4.7 tpp180 -67.24 -40.61 86.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.404 0.621 . . . . 4.9100000000000001 110.015 179.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.529 HG22 ' CE2' ' A' ' 104' ' ' PHE . 69.8 mt -72.17 -39.39 64.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.407 -0.815 . . . . 1.1100000000000001 110.125 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 97' ' ' TRP . 55.2 t -53.44 -46.99 59.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.837 -0.619 . . . . 2.0299999999999998 110.233 172.278 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -49.31 -51.71 32.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.179 -0.918 . . . . 1.0600000000000001 110.888 174.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -54.63 -44.52 73.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.252 -0.886 . . . . 1.8400000000000001 110.961 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.817 ' HA ' ' HE1' ' A' ' 130' ' ' MET . 57.3 m-85 -64.77 -43.27 93.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.646 0.26 . . . . 4.21 111.146 176.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.512 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 27.3 m -60.9 -49.97 75.31 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.181 -0.463 . . . . 1.55 110.864 -177.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.52 ' CZ ' ' HE2' ' A' ' 57' ' ' PHE . 33.0 m-85 -72.23 -33.63 67.7 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.399 -0.364 . . . . 3.6400000000000001 110.875 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.689 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -69.07 -41.63 80.37 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.569 -0.825 . . . . 0.32000000000000001 111.879 177.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.824 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.46 -37.55 90.12 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.75 -0.738 . . . . 0.23999999999999999 111.483 176.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.21 -28.54 64.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.768 0.318 . . . . 1.05 110.482 176.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.584 ' HB3' HD11 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -64.02 -43.17 96.42 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 108.209 -1.034 . . . . 1.78 108.209 179.286 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.619 ' SG ' HG13 ' A' ' 123' ' ' VAL . 19.5 t -53.27 -55.03 27.85 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 113.861 -1.518 . . . . 0.90000000000000002 110.534 173.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.462 HG13 ' HG3' ' A' ' 20' ' ' LYS . 71.8 t -63.36 -41.28 92.16 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-N 116.127 -0.488 . . . . 1.2 111.624 -178.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.725 ' HB3' HG22 ' A' ' 74' ' ' ILE . 37.2 mm-40 -63.7 -21.95 66.66 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.052 0.453 . . . . 2.5099999999999998 111.254 178.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.533 ' HA ' ' HE1' ' A' ' 119' ' ' MET . 36.9 m -76.2 -40.86 51.24 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.618 -0.882 . . . . 0.28000000000000003 108.618 172.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.585 HG21 ' O ' ' A' ' 111' ' ' CYS . 81.0 t -66.62 -37.37 79.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.967 0.889 . . . . 1.8300000000000001 109.628 -178.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -52.41 -50.21 62.96 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 113.38 -1.736 . . . . 0.59999999999999998 111.37 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.498 ' HE2' ' O ' ' A' ' 113' ' ' GLU . 11.2 mmtt -90.73 14.96 12.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.491 . . . . 2.1600000000000001 110.525 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 63.55 53.12 2.14 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.81 0.814 . . . . 1.8799999999999999 111.075 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.533 ' HE1' ' HA ' ' A' ' 114' ' ' SER . 25.5 mtm -130.1 44.27 2.99 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.804 -1.089 . . . . 1.0800000000000001 108.073 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.464 ' HG2' HG11 ' A' ' 115' ' ' VAL . 4.5 mt-30 -60.92 -7.57 2.51 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.786 -1.097 . . . . 1.1499999999999999 113.068 -174.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.578 HG22 HD23 ' A' ' 122' ' ' LEU . 35.0 m -65.43 -26.04 38.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 122.225 -0.297 . . . . 1.1899999999999999 111.089 175.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.756 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -72.51 -27.75 62.45 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.463 -0.335 . . . . 1.0600000000000001 110.536 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.619 HG13 ' SG ' ' A' ' 111' ' ' CYS . 68.0 t -43.65 -53.03 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 O-C-N 123.968 0.793 . . . . 1.0 111.936 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.562 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 10.3 t -72.14 -40.46 68.04 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.748 0.309 . . . . 1.6599999999999999 110.932 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.756 ' HD2' HD13 ' A' ' 122' ' ' LEU . 92.0 mtt180 -59.98 -53.86 52.85 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 116.158 -0.474 . . . . 3.2999999999999998 110.589 -176.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.63 ' HA ' ' CZ2' ' A' ' 129' ' ' TRP . 87.2 mt -52.41 -48.4 45.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.361 -0.836 . . . . 1.0600000000000001 110.99 -178.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.549 ' HB2' HD21 ' A' ' 13' ' ' LEU . . . -60.14 -27.46 67.1 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.147 0.425 . . . . 1.1000000000000001 112.147 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.78 -61.41 2.08 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 121.486 0.66 . . . . 1.1200000000000001 110.358 -177.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.63 ' CZ2' ' HA ' ' A' ' 126' ' ' ILE . 27.3 p-90 -80.03 -18.07 51.13 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.169 -0.923 . . . . 4.7699999999999996 111.799 -176.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.817 ' HE1' ' HA ' ' A' ' 104' ' ' PHE . 12.4 mmm -58.12 -54.1 50.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.396 0.617 . . . . 1.0900000000000001 109.446 168.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.546 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -64.63 -41.52 96.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.586 -0.734 . . . . 1.05 110.888 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.499 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 70.1 m -57.9 -50.32 73.73 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.98 0.363 . . . . 1.1299999999999999 111.98 176.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.531 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 4.4 m-85 -59.34 -34.77 72.76 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.263 -0.175 . . . . 3.3500000000000001 111.194 -178.211 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.64 HD11 ' HB3' ' A' ' 5' ' ' ASN . 4.2 tt -62.02 -55.99 23.63 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.218 -1.03 . . . . 1.5900000000000001 108.218 170.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.0 m-80 -47.08 -51.3 18.01 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.114 -0.948 . . . . 0.46000000000000002 112.606 -178.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -84.76 -45.78 12.05 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.203 0.446 . . . . 0.58999999999999997 112.203 -173.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . 0.531 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 18.3 m-70 -91.02 -49.92 6.14 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.734 0.642 . . . . 2.3399999999999999 112.734 -171.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 46.7 mt -91.06 -36.75 13.85 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.784 0.661 . . . . 1.8999999999999999 112.784 -165.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.64 ' HA ' HD11 ' A' ' 142' ' ' ILE . 31.5 tt0 -49.77 -50.73 65.7 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 123.54 0.525 . . . . 0.75 112.25 -173.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.576 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 35.2 Cg_exo -57.19 -49.84 12.9 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 121.61 1.54 . . . . 0.87 111.494 176.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . 0.423 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 4.0 t-105 -57.74 -49.26 77.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.489 -0.778 . . . . 1.4299999999999999 110.477 -178.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.64 HD11 ' HA ' ' A' ' 139' ' ' GLU . 47.0 mt -45.27 -53.32 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 122.953 0.501 . . . . 1.1299999999999999 111.655 173.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.622 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.7 mm-40 -59.4 -32.35 70.08 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.91 -0.586 . . . . 0.57999999999999996 111.513 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.567 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.2 mm-40 -66.42 -19.38 65.78 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.248 0.547 . . . . 0.78000000000000003 110.909 178.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -109.75 2.5 20.11 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.478 -0.783 . . . . 0.93000000000000005 110.725 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 126.87 -48.32 0.97 Allowed Glycine 0 N--CA 1.442 -0.961 0 CA-C-N 115.669 -0.696 . . . . 0.56000000000000005 113.075 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 126.08 172.67 13.41 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.852 -0.69 . . . . 0.48999999999999999 111.45 -177.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.655 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 67.1 m95 -65.02 -36.42 84.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.901 0.351 . . . . 4.5199999999999996 111.611 -176.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.576 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 6.0 p-10 -59.95 -33.03 71.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.836 0.35 . . . . 1.96 110.634 177.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.518 ' O ' HD12 ' A' ' 154' ' ' LEU . 89.4 m -68.04 -39.99 82.93 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.047 -0.524 . . . . 1.24 110.935 178.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.573 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 85.9 t80 -61.53 -33.03 73.13 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.942 -0.762 . . . . 3.7200000000000002 108.942 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.576 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 99.0 t -63.08 -55.71 21.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-N 114.569 -1.196 . . . . 1.8600000000000001 110.786 174.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 9.5 mm-40 -47.76 -46.73 30.46 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.469 -0.787 . . . . 1.6699999999999999 111.538 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 150' ' ' THR . 8.4 mp -75.68 -61.18 2.01 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.233 0.827 . . . . 1.96 113.233 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -120.79 21.18 11.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.487 -0.324 . . . . 4.3899999999999997 111.822 -166.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.703 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -67.25 179.08 15.6 Favored Glycine 0 N--CA 1.45 -0.422 0 N-CA-C 115.729 1.051 . . . . 1.1000000000000001 115.729 -172.169 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 . . . . . 0 N--CA 1.441 -0.886 0 CA-C-N 113.208 -1.496 . . . . 1.29 110.683 -177.06 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.195 0 N-CA-C 112.774 -0.131 . . . . 1.26 112.774 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B 1006 ' ' ARG . . . . . 0.529 ' HA ' ' CZ ' ' B' 1006 ' ' ARG . 1.6 tpm_? -56.32 -52.3 65.07 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.707 0.765 . . . . 3.4500000000000002 111.669 172.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B 1007 ' ' ALA . . . . . 0.473 ' HB1' HD23 ' B' 1008 ' ' LEU . . . -99.67 -153.5 0.44 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.571 -1.195 . . . . 1.54 110.063 -172.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 1.019 ' HG ' HG12 ' A' ' 86' ' ' VAL . 2.8 mm? 64.43 -74.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 O-C-N 123.963 0.789 . . . . 1.8999999999999999 111.384 174.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 1.004 ' HB2' ' HB3' ' A' ' 89' ' ' GLU . . . -46.06 -64.3 0.78 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.632 0.73 . . . . 1.45 110.574 169.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B 1010 ' ' ALA . . . . . 0.41 ' O ' ' HB3' ' B' 1013 ' ' ASP . . . -52.5 -40.06 61.97 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 114.597 -1.183 . . . . 1.51 112.43 -178.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -98.75 7.02 46.55 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.188 -0.46 . . . . 2.0699999999999998 111.297 -172.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.79 -16.89 79.16 Favored Glycine 0 CA--C 1.501 -0.787 0 N-CA-C 108.726 -1.75 . . . . 0.80000000000000004 108.726 166.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B 1013 ' ' ASP . . . . . 0.41 ' HB3' ' O ' ' B' 1010 ' ' ALA . 17.4 t70 -72.78 -2.88 22.19 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.36 -1.42 . . . . 1.8999999999999999 110.863 171.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B 1014 ' ' CYS . . . . . 0.694 ' SG ' ' HB3' ' A' ' 60' ' ' ARG . 15.3 t . . . . . 0 C--N 1.34 0.177 0 CA-C-O 121.334 0.588 . . . . 1.4399999999999999 110.057 178.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 . . . . . 0 N--CA 1.46 0.047 0 CA-C-O 120.865 0.364 . . . . 2.7599999999999998 111.257 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -20.67 66.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.3 -0.409 . . . . 1.54 111.461 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.934 ' HA ' HD22 ' A' ' 8' ' ' LEU . 70.1 m-20 -64.65 -22.35 66.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.21 -0.45 . . . . 1.78 110.477 178.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.802 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.2 tpp180 -54.81 -52.95 61.09 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.814 -0.63 . . . . 1.8999999999999999 110.449 176.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.758 ' HB3' ' HE3' ' A' ' 47' ' ' LYS . 46.9 mt-10 -57.94 -46.39 85.13 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.274 -0.876 . . . . 0.68000000000000005 110.905 -177.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.934 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.2 OUTLIER -52.77 -32.49 43.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.078 -0.965 . . . . 1.8 111.217 179.304 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.487 HG23 ' N ' ' A' ' 131' ' ' ALA . 67.7 t -80.24 -61.1 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.308 0.575 . . . . 1.0700000000000001 109.8 174.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.521 HG11 ' CE2' ' A' ' 24' ' ' TRP . 95.2 t -50.1 -54.77 7.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.815 -1.084 . . . . 1.1299999999999999 112.506 -175.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -49.24 -43.28 42.59 Favored 'General case' 0 CA--C 1.52 -0.205 0 O-C-N 123.472 0.482 . . . . 0.58999999999999997 110.57 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.616 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 1.6 t80 -72.43 -42.44 65.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.879 -0.6 . . . . 2.02 111.077 -175.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.959 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.2 mp -62.75 -40.39 97.11 Favored 'General case' 0 C--O 1.231 0.124 0 C-N-CA 120.277 -0.569 . . . . 1.0600000000000001 110.185 177.027 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.7 m -62.57 -39.11 92.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.553 0.692 . . . . 1.6000000000000001 109.929 176.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -63.81 -18.7 64.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.739 -1.118 . . . . 1.49 111.024 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.66 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.7 mmpt? -90.57 -52.77 4.73 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.31 0.576 . . . . 1.8400000000000001 110.054 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.598 HD22 HG21 ' A' ' 112' ' ' VAL . 13.6 mt -55.36 -31.41 61.73 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.687 -1.142 . . . . 1.98 111.419 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.8 t -60.41 -31.1 70.07 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.962 -0.563 . . . . 1.3799999999999999 111.621 177.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -75.68 -21.42 57.64 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-O 121.792 0.806 . . . . 1.51 110.448 -178.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.52 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 9.8 mmmt -96.45 -26.58 15.26 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.224 -1.353 . . . . 2.6499999999999999 108.665 -174.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.03 19.4 17.08 Favored Glycine 0 N--CA 1.437 -1.295 0 CA-C-N 113.744 -1.571 . . . . 0.54000000000000004 111.976 176.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.52 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 31.8 m-85 -99.63 154.9 17.91 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.753 0.311 . . . . 1.1200000000000001 110.343 177.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.0 t -92.29 142.81 27.05 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.998 -0.546 . . . . 0.75 109.572 175.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.642 ' HZ2' HG21 ' A' ' 30' ' ' VAL . 27.9 t-105 -74.5 -49.44 22.13 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.622 -0.51 . . . . 4.29 109.622 176.079 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.8 m -58.94 -35.89 73.86 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.771 -0.65 . . . . 1.8600000000000001 111.725 -176.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -61.64 -25.78 67.58 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.894 0.378 . . . . 1.52 111.965 -178.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -120.24 19.15 12.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.358 -0.383 . . . . 1.53 110.933 -178.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.443 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 37.4 p -100.26 -178.85 3.95 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.625 0.726 . . . . 2.04 112.097 -172.153 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.53 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 5.4 t70 -161.52 -23.9 0.05 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.403 -1.271 . . . . 2.3100000000000001 108.899 -178.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.675 HG22 ' H ' ' A' ' 31' ' ' GLU . 3.4 m -53.91 -72.43 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 114.269 -1.332 . . . . 1.4099999999999999 112.827 -175.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.675 ' H ' HG22 ' A' ' 30' ' ' VAL . 32.4 mt-10 -89.69 -4.26 57.82 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.632 -0.877 . . . . 2.7400000000000002 108.632 178.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.53 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 23.2 tt0 . . . . . 0 N--CA 1.443 -0.802 0 CA-C-N 114.45 -1.25 . . . . 1.45 111.222 -175.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.798 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.2 t . . . . . 0 CA--C 1.54 0.584 0 CA-C-O 120.537 0.208 . . . . 1.45 110.547 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.798 ' H ' HG23 ' A' ' 41' ' ' THR . 14.2 pt-20 -92.88 -30.95 15.15 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 122.27 1.033 . . . . 2.02 108.315 168.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.57 -35.57 68.33 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 112.742 -2.027 . . . . 1.25 113.425 -170.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -45.17 -53.48 8.09 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 123.967 0.792 . . . . 1.9099999999999999 111.721 -173.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.419 ' HB2' HG23 ' A' ' 152' ' ' VAL . . . -72.39 -38.96 68.34 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.794 0.294 . . . . 1.1799999999999999 111.794 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.66 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 1.4 m -71.47 -41.71 72.92 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 120.939 -0.305 . . . . 2.0099999999999998 111.016 -175.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.758 ' HE3' ' HB3' ' A' ' 7' ' ' GLU . 0.4 OUTLIER -71.77 -30.24 65.35 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.298 -0.63 . . . . 1.3799999999999999 109.298 178.742 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.495 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 3.1 mm100 -64.61 -35.68 81.79 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.98999999999999999 110.266 172.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.584 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -75.65 -34.23 60.5 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.114 -0.493 . . . . 1.1399999999999999 110.597 176.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.66 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 12.5 mt -64.02 -28.0 69.5 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 115.514 -0.767 . . . . 1.95 112.364 -176.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 7.9 ptm180 -81.07 -30.72 34.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.861 0.839 . . . . 2.5099999999999998 108.998 -176.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -74.99 -49.93 18.28 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.172 -1.376 . . . . 1.1000000000000001 109.786 -178.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.45 -34.12 77.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.724 -0.671 . . . . 1.04 109.87 175.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.748 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -58.7 -57.33 20.42 Favored Glycine 0 N--CA 1.442 -0.911 0 CA-C-N 115.262 -0.881 . . . . 0.69999999999999996 111.758 177.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -55.12 -43.16 73.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.807 0.337 . . . . 1.04 111.265 -177.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -59.5 -34.25 72.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.771 -0.65 . . . . 2.29 111.479 177.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.613 ' CE1' ' HA2' ' B' 1012 ' ' GLY . 67.0 t80 -81.6 -40.48 22.93 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.912 -0.585 . . . . 2.9300000000000002 111.323 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.748 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 56.9 mt-10 -62.92 -42.19 99.72 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.314 -0.403 . . . . 1.3 111.745 -173.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.1 pp -59.73 -19.09 47.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.22 -0.446 . . . . 2.1899999999999999 111.526 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 32.8 mtp-105 -79.7 -53.67 6.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.087 -0.506 . . . . 3.1400000000000001 110.953 -179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.636 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 15.3 p90 -92.18 -5.72 52.04 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.672 0.619 . . . . 5.5899999999999999 112.672 -172.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.789 ' HG3' ' HE1' ' A' ' 65' ' ' PHE . 50.8 ttt180 -50.99 -38.49 51.45 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.28 0.474 . . . . 4.9299999999999997 112.28 -170.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -52.85 -38.14 61.11 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.051 0.389 . . . . 5.3499999999999996 112.051 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.433 ' O ' HD12 ' A' ' 68' ' ' LEU . . . -82.78 -48.82 10.39 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 112.906 0.706 . . . . 1.7 112.906 -172.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.789 ' HE1' ' HG3' ' A' ' 62' ' ' ARG . 5.1 p90 -60.04 -26.99 66.55 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.49 0.552 . . . . 3.52 112.49 -166.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.1 t -68.02 -32.71 73.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.154 0.502 . . . . 2.5899999999999999 110.106 177.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -90.13 -25.82 20.5 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.583 0.706 . . . . 2.7200000000000002 110.397 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.709 ' O ' HD13 ' A' ' 72' ' ' LEU . 2.0 mp -75.31 -18.02 60.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.292 -0.867 . . . . 2.25 112.424 -176.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.731 HG23 HG13 ' A' ' 74' ' ' ILE . 1.2 p -57.3 -34.42 68.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 118.147 0.431 . . . . 1.26 111.043 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 45.6 t -63.88 -41.7 97.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.385 0.612 . . . . 1.8 109.924 173.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.659 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 9.0 mt-30 -66.77 -39.12 87.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.113 -0.949 . . . . 1.8899999999999999 110.652 -178.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.709 HD13 ' O ' ' A' ' 68' ' ' LEU . 1.1 mt -76.2 -30.15 57.89 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.552 -0.749 . . . . 1.98 110.408 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 68.55 50.72 0.67 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.447 0.642 . . . . 3.54 109.616 -176.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.731 HG13 HG23 ' A' ' 69' ' ' THR . 25.5 mm -55.47 114.93 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.609 -1.178 . . . . 1.1499999999999999 111.419 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.764 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.95 -170.24 0.24 Allowed Pre-proline 0 CA--C 1.549 0.923 0 N-CA-C 107.514 -1.291 . . . . 1.1200000000000001 107.514 -171.566 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.764 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 32.2 Cg_exo -29.33 167.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.128 0 C-N-CA 125.218 3.945 . . . . 0.53000000000000003 115.326 162.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -28.56 -27.46 0.0 OUTLIER Glycine 0 N--CA 1.475 1.239 0 N-CA-C 117.828 1.891 . . . . 0.40999999999999998 117.828 -173.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.469 ' N ' ' O ' ' A' ' 76' ' ' PRO . 40.7 p -65.67 1.93 1.13 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 118.946 1.373 . . . . 1.22 112.0 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.26 -12.16 60.76 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.551 -0.295 . . . . 1.0700000000000001 110.262 174.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.451 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 2.8 m-85 -73.62 -22.85 59.88 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.644 -0.872 . . . . 4.3099999999999996 108.644 174.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -81.95 -26.15 34.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.392 -0.822 . . . . 1.03 109.725 176.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.626 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 3.2 m -73.54 -51.51 16.72 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.63 -1.168 . . . . 0.47999999999999998 109.05 172.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.79 ' HA ' HG21 ' A' ' 86' ' ' VAL . 69.3 t80 -67.66 -17.89 64.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.115 -0.948 . . . . 1.4399999999999999 110.276 176.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.565 ' HA ' HG11 ' A' ' 87' ' ' VAL . 42.5 tt0 -61.64 -50.56 72.05 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.925 -0.579 . . . . 0.80000000000000004 110.409 177.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -47.23 -33.33 5.31 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 114.856 -1.066 . . . . 1.99 110.311 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.827 HG12 HD13 ' B' 1008 ' ' LEU . 1.3 t -85.91 -55.13 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.981 0 CA-C-N 114.01 -1.45 . . . . 1.8999999999999999 110.912 -174.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.565 HG11 ' HA ' ' A' ' 84' ' ' GLU . 4.9 p -62.86 -17.95 20.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-O 122.098 0.951 . . . . 1.4299999999999999 109.959 -176.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.564 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 4.5 m-80 -86.02 -35.58 20.26 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.148 -1.387 . . . . 0.91000000000000003 112.057 176.073 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 1.012 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.2 pp20? -74.65 -35.58 62.85 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 122.107 0.956 . . . . 2.8700000000000001 108.518 177.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.633 HD11 ' OE2' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -67.13 -33.36 75.28 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 113.569 -1.651 . . . . 1.9199999999999999 110.879 -167.921 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.658 ' HA ' HG23 ' A' ' 95' ' ' VAL . 2.9 p90 -98.53 -16.62 19.09 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.774 -0.37 . . . . 2.9700000000000002 111.097 -174.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.623 ' CD ' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -88.81 -30.15 19.19 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.35 -0.54 . . . . 5.6699999999999999 111.139 -177.179 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -92.24 2.63 56.5 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.662 0.616 . . . . 3.1200000000000001 112.662 -168.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 131.67 71.78 0.1 OUTLIER Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 117.339 -2.362 . . . . 2.3100000000000001 114.954 -174.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.658 HG23 ' HA ' ' A' ' 91' ' ' PHE . 49.1 t -70.14 98.52 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 118.144 0.972 . . . . 1.6799999999999999 110.492 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.615 HD21 ' N ' ' A' ' 96' ' ' ASN . 0.7 OUTLIER -108.93 -179.06 3.75 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.311 -1.313 . . . . 2.1200000000000001 108.902 178.1 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.799 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 19.3 m-90 -51.37 -52.9 41.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.224 0.535 . . . . 4.1200000000000001 111.015 176.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.522 ' O ' ' HB ' ' A' ' 101' ' ' VAL . . . -81.36 -14.18 79.12 Favored Glycine 0 CA--C 1.519 0.324 0 CA-C-N 115.759 -0.655 . . . . 0.80000000000000004 113.637 -175.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.573 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 9.4 tpp180 -63.21 -42.4 99.28 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.291 0.567 . . . . 4.9100000000000001 110.496 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.565 HG23 ' CE2' ' A' ' 104' ' ' PHE . 89.8 mt -72.89 -33.61 44.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.671 . . . . 1.1100000000000001 110.438 -179.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.522 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 72.8 t -49.1 -54.45 5.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.764 -0.653 . . . . 2.0299999999999998 109.804 168.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.49 -47.22 66.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.886 -1.052 . . . . 1.0600000000000001 111.126 175.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -55.56 -39.67 70.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.579 -0.737 . . . . 1.8400000000000001 111.395 178.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.565 ' CE2' HG23 ' A' ' 100' ' ' ILE . 30.7 m-85 -69.92 -33.74 72.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.632 0.253 . . . . 4.21 110.88 175.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.616 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 18.1 t -68.58 -53.84 20.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.484 -0.325 . . . . 1.55 110.674 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.549 ' CZ ' ' HB3' ' B' 1008 ' ' LEU . 35.4 m-85 -63.98 -38.63 91.78 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-O 120.552 0.215 . . . . 3.6400000000000001 110.581 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -69.82 -39.18 76.32 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.619 -0.801 . . . . 0.32000000000000001 111.792 177.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.959 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.04 -36.19 91.63 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 111.303 -0.719 . . . . 0.23999999999999999 111.303 176.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -73.59 -29.14 62.21 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.229 -0.285 . . . . 1.05 110.229 175.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.46 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -61.3 -40.68 95.07 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 107.723 -1.214 . . . . 1.78 107.723 178.155 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.72 ' HG ' HG12 ' A' ' 123' ' ' VAL . 39.9 t -51.57 -63.73 1.04 Allowed 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 113.612 -1.631 . . . . 0.90000000000000002 110.174 172.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.768 ' HA ' HG11 ' A' ' 115' ' ' VAL . 43.6 t -64.15 -37.89 81.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.202 0.445 . . . . 1.2 112.202 -174.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.576 ' HB3' HG21 ' A' ' 74' ' ' ILE . 13.6 mm-40 -59.52 -16.95 27.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.185 0.517 . . . . 2.5099999999999998 110.767 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.595 ' HA ' ' HE2' ' A' ' 119' ' ' MET . 63.9 m -85.1 -46.86 10.74 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 107.997 -1.112 . . . . 0.28000000000000003 107.997 176.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.768 HG11 ' HA ' ' A' ' 112' ' ' VAL . 1.7 m -66.38 -34.22 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-N 114.783 -1.099 . . . . 1.8300000000000001 109.897 -174.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -50.32 -51.31 46.45 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 113.066 -1.879 . . . . 0.59999999999999998 111.153 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.421 ' CG ' ' HE3' ' A' ' 119' ' ' MET . 24.1 mmtt -86.0 15.5 4.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.796 -0.638 . . . . 2.1600000000000001 110.109 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.483 ' HA ' ' NE2' ' A' ' 120' ' ' GLN . 39.0 mt-10 65.89 49.29 1.67 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 122.037 0.922 . . . . 1.8799999999999999 110.176 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.595 ' HE2' ' HA ' ' A' ' 114' ' ' SER . 27.9 mtm -129.59 37.12 4.02 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.329 -1.305 . . . . 1.0800000000000001 107.889 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.725 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 1.9 mp0 -54.51 -8.05 0.2 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.921 -1.036 . . . . 1.1499999999999999 112.684 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.608 HG23 HD22 ' A' ' 122' ' ' LEU . 27.3 m -68.25 -22.5 27.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 O-C-N 122.102 -0.374 . . . . 1.1899999999999999 111.868 176.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.622 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.6 mm? -75.26 -24.89 57.66 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 120.956 0.408 . . . . 1.0600000000000001 110.137 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.72 HG12 ' HG ' ' A' ' 111' ' ' CYS . 46.7 t -45.19 -52.55 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 114.857 -1.065 . . . . 1.0 112.346 -176.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.443 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 0.1 OUTLIER -75.46 -33.59 60.86 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 121.044 0.449 . . . . 1.6599999999999999 111.196 -178.468 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.622 ' HD2' HD13 ' A' ' 122' ' ' LEU . 74.0 mtt180 -65.97 -52.5 49.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.67 -0.695 . . . . 3.2999999999999998 110.738 -176.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.557 HG22 ' SD ' ' A' ' 130' ' ' MET . 69.5 mt -53.6 -49.97 52.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.769 -0.651 . . . . 1.0600000000000001 111.331 179.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.672 ' HB3' HD23 ' A' ' 13' ' ' LEU . . . -58.17 -32.53 68.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.624 -0.262 . . . . 1.1000000000000001 111.58 -177.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.802 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -58.75 -61.68 2.44 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.198 0.523 . . . . 1.1200000000000001 110.353 176.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -62.11 -35.67 79.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.86 -1.064 . . . . 4.7699999999999996 111.2 -176.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.557 ' SD ' HG22 ' A' ' 126' ' ' ILE . 88.2 mtp -60.86 -54.59 43.18 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.779 0.323 . . . . 1.0900000000000001 111.435 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.487 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -62.23 -43.01 99.79 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.26 -0.427 . . . . 1.05 111.004 -178.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 97.2 m -61.4 -44.39 97.23 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.838 -0.345 . . . . 1.1299999999999999 110.695 177.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.45 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 26.6 t80 -56.7 -40.24 75.27 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.153 -0.314 . . . . 3.3500000000000001 110.153 178.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.899 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 3.8 tt -61.42 -54.88 37.8 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.78 -0.822 . . . . 1.5900000000000001 108.78 174.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -51.75 -44.02 63.16 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.181 -0.918 . . . . 0.46000000000000002 112.426 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -84.68 -52.69 5.9 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.215 0.531 . . . . 0.58999999999999997 111.906 -175.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . 0.45 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 7.2 m80 -91.4 -51.77 5.12 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 113.124 0.787 . . . . 2.3399999999999999 113.124 -171.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.899 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -80.74 -45.6 16.8 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.007 1.114 . . . . 1.8999999999999999 114.007 -165.081 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.706 ' HA ' HD12 ' A' ' 142' ' ' ILE . 27.6 tt0 -44.99 -50.29 26.74 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 112.689 0.626 . . . . 0.75 112.689 -174.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.546 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 51.3 Cg_exo -54.38 -50.87 12.0 Favored 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 121.856 1.704 . . . . 0.87 111.861 176.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 -58.02 -49.5 76.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.529 -0.759 . . . . 1.4299999999999999 110.31 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.706 HD12 ' HA ' ' A' ' 139' ' ' GLU . 61.8 mt -46.58 -53.91 2.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.921 -0.581 . . . . 1.1299999999999999 111.683 175.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.552 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 72.3 mm-40 -60.14 -30.72 69.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.846 -0.616 . . . . 0.57999999999999996 111.739 -178.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.546 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 6.4 mm-40 -68.28 -22.9 64.71 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.354 0.597 . . . . 0.78000000000000003 110.746 177.161 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.629 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -99.54 -20.9 16.15 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.421 -0.808 . . . . 0.93000000000000005 110.151 -173.071 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 146.7 -33.57 1.4 Allowed Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.791 -0.719 . . . . 0.56000000000000005 112.686 175.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . 0.538 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 110.1 169.92 19.89 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.565 -0.826 . . . . 0.48999999999999999 111.844 -177.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.566 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 65.2 m95 -68.03 -34.39 76.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.731 0.265 . . . . 4.5199999999999996 111.568 -178.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -58.25 -47.1 84.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.067 0.46 . . . . 1.96 110.243 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.526 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 95.4 m -61.0 -35.37 76.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.606 -0.724 . . . . 1.24 111.178 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.799 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 84.0 t80 -59.54 -40.96 88.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.742 0.306 . . . . 3.7200000000000002 110.672 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.594 HG11 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -73.8 -24.94 20.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.322 0.582 . . . . 1.8600000000000001 110.089 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.78 -22.45 66.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.066 0.46 . . . . 1.6699999999999999 109.948 173.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 150' ' ' THR . 5.0 mt -94.33 -58.34 2.24 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.916 -0.584 . . . . 1.96 110.779 177.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -121.25 27.74 8.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.976 -0.556 . . . . 4.3899999999999997 111.591 -173.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.584 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -65.7 163.43 40.24 Favored Glycine 0 CA--C 1.497 -1.083 0 C-N-CA 120.865 -0.683 . . . . 1.1000000000000001 113.056 -178.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . 0.495 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 24.9 t-20 . . . . . 0 C--N 1.308 -1.23 0 CA-C-N 114.205 -0.998 . . . . 1.29 110.68 178.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.937 0 N-CA-C 113.708 0.243 . . . . 1.26 113.708 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -94.07 -40.48 10.05 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 111.922 0.341 . . . . 3.4500000000000002 111.922 176.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -78.52 -48.16 15.87 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 113.119 0.785 . . . . 1.54 113.119 -167.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.827 HD13 HG12 ' A' ' 86' ' ' VAL . 7.7 mt -75.22 -37.31 61.17 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.279 -0.637 . . . . 1.8999999999999999 109.279 -171.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 1.012 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -52.86 -49.79 65.09 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.002 -0.999 . . . . 1.45 110.169 169.161 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -68.28 -50.18 55.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.283 -1.326 . . . . 1.51 111.966 -176.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -73.14 -23.17 60.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.138 -0.483 . . . . 2.0699999999999998 111.478 -177.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1012 ' ' GLY . . . . . 0.613 ' HA2' ' CE1' ' A' ' 57' ' ' PHE . . . -74.61 -10.1 82.66 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 121.018 -0.611 . . . . 0.80000000000000004 113.01 -177.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -74.51 -20.96 59.78 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.08 0.467 . . . . 1.8999999999999999 110.898 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.453 -0.318 0 CA-C-N 116.447 -0.342 . . . . 1.4399999999999999 110.886 -175.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.08 0.467 . . . . 2.7599999999999998 110.13 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.11 -17.69 64.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.458 -0.792 . . . . 1.54 112.467 -177.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.66 ' ND2' HD22 ' A' ' 134' ' ' LEU . 21.8 m-20 -67.86 -15.76 63.77 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 120.52 -0.472 . . . . 1.78 110.005 178.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.541 HH12 ' HA ' ' A' ' 128' ' ' ALA . 12.3 tpp180 -56.83 -48.91 76.95 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.921 -0.581 . . . . 1.8999999999999999 109.747 174.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.462 ' HB3' ' CE ' ' A' ' 47' ' ' LYS . 33.9 mt-10 -53.49 -51.81 61.58 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.768 -1.105 . . . . 0.68000000000000005 111.118 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.611 HD21 ' HA ' ' A' ' 5' ' ' ASN . 1.2 mp -49.13 -35.04 15.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.864 -1.062 . . . . 1.8 111.499 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.512 HG22 ' N ' ' A' ' 131' ' ' ALA . 72.4 t -80.63 -59.54 2.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.837 -0.62 . . . . 1.0700000000000001 110.375 175.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.524 HG22 ' O ' ' A' ' 6' ' ' ARG . 85.0 t -51.96 -55.64 8.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.852 -1.067 . . . . 1.1299999999999999 113.059 -176.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -54.97 -30.85 60.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.974 0.416 . . . . 0.58999999999999997 110.493 -176.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.733 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 4.0 t80 -79.18 -51.51 9.41 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.889 -0.596 . . . . 2.02 110.546 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.932 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.0 mp -58.89 -42.95 90.77 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 121.01 -0.276 . . . . 1.0600000000000001 110.899 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.406 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 38.4 t -58.39 -40.43 82.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.283 0.563 . . . . 1.6000000000000001 110.424 178.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -71.56 -23.75 61.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.795 -0.639 . . . . 1.49 110.289 -179.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.608 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.2 mmpt? -85.1 -28.78 25.36 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 116.457 -0.338 . . . . 1.8400000000000001 110.929 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.473 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -72.73 -26.33 61.54 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.066 -0.654 . . . . 1.98 109.396 172.783 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.7 t -65.18 -33.78 76.82 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.58 -0.736 . . . . 1.3799999999999999 111.735 -178.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 16.8 pt20 -76.11 -6.04 49.35 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.367 0.603 . . . . 1.51 111.022 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.539 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.5 mmmt -109.01 -27.78 9.46 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.961 0.886 . . . . 2.6499999999999999 108.854 -178.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.4 23.25 9.69 Favored Glycine 0 N--CA 1.441 -1.009 0 CA-C-N 113.996 -1.457 . . . . 0.54000000000000004 111.438 177.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.509 ' HD2' ' HZ ' ' A' ' 27' ' ' PHE . 84.4 m-85 -110.55 163.58 13.57 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.033 0.444 . . . . 1.1200000000000001 111.003 179.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.8 t -101.42 145.37 29.04 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.821 -0.627 . . . . 0.75 110.176 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.412 ' NE1' HG11 ' A' ' 10' ' ' VAL . 0.5 OUTLIER -69.78 -47.46 62.82 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.044 -0.526 . . . . 4.29 110.713 176.573 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.7 t -75.6 -23.18 56.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.417 -0.356 . . . . 1.8600000000000001 111.599 -170.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -61.39 -25.47 67.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.222 0.534 . . . . 1.52 111.124 176.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.509 ' HZ ' ' HD2' ' A' ' 22' ' ' TYR . 6.6 m-85 -113.09 -22.21 10.66 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.979 -0.555 . . . . 1.53 111.16 -176.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.571 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 19.3 m -101.24 144.87 29.58 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 122.32 1.057 . . . . 2.04 112.163 -178.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -118.18 -5.21 10.92 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.379 -1.737 . . . . 2.3100000000000001 109.512 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.684 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.4 m -53.57 -73.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.135 -1.393 . . . . 1.4099999999999999 113.257 -165.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.684 ' H ' HG23 ' A' ' 30' ' ' VAL . 10.4 pt-20 -96.97 2.12 51.15 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.122 -0.696 . . . . 2.7400000000000002 109.122 177.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 . . . . . 0 N--CA 1.449 -0.516 0 CA-C-N 114.761 -1.108 . . . . 1.45 110.803 179.544 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.855 HG22 ' H ' ' A' ' 42' ' ' GLU . 3.5 t . . . . . 0 CA--C 1.543 0.703 0 N-CA-C 110.543 -0.169 . . . . 1.45 110.543 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.855 ' H ' HG22 ' A' ' 41' ' ' THR . 13.4 pt-20 -94.45 -32.19 13.64 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 122.384 1.088 . . . . 2.02 109.789 171.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.671 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 51.7 m -62.71 -24.53 67.71 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 113.206 -1.815 . . . . 1.25 114.816 -165.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -39.42 -55.52 1.75 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.517 0.511 . . . . 1.9099999999999999 112.251 -172.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.449 ' HB2' HG23 ' A' ' 152' ' ' VAL . . . -70.52 -40.07 73.72 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.796 0.295 . . . . 1.1799999999999999 111.796 179.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.659 ' HB ' ' HB3' ' A' ' 148' ' ' TRP . 2.0 m -67.74 -44.2 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 121.239 -0.185 . . . . 2.0099999999999998 111.189 -176.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.671 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.8 ptpt -69.93 -39.42 76.12 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.536 -0.542 . . . . 1.3799999999999999 109.536 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.533 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 6.0 mm100 -59.1 -33.62 71.05 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.714 -0.676 . . . . 0.98999999999999999 111.17 174.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.527 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -76.83 -39.41 51.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.39 0.614 . . . . 1.1399999999999999 110.716 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.413 HD11 ' CE2' ' A' ' 151' ' ' PHE . 1.0 OUTLIER -65.79 -25.97 67.48 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.286 -0.87 . . . . 1.95 112.548 -174.63 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.533 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.2 ptp180 -83.34 -27.46 29.7 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.8 0.81 . . . . 2.5099999999999998 109.335 -175.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.505 ' HG2' ' HG3' ' A' ' 51' ' ' ARG . 4.3 mm-40 -80.17 -39.96 28.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.201 -1.363 . . . . 1.1000000000000001 109.715 -179.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.52 -41.57 75.85 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.581 -0.736 . . . . 1.04 109.836 172.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.641 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.13 -31.96 74.65 Favored Glycine 0 C--O 1.222 -0.617 0 CA-C-N 115.533 -0.758 . . . . 0.69999999999999996 111.577 177.052 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -54.26 -39.16 66.6 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 122.591 0.356 . . . . 1.04 111.032 177.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.44 ' HA ' HD21 ' A' ' 59' ' ' LEU . 2.9 tt0 -79.66 -26.48 41.03 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.667 0.746 . . . . 2.29 110.574 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -80.99 -18.41 47.0 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.084 -0.507 . . . . 2.9300000000000002 112.269 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.641 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 40.1 mt-10 -66.95 -68.49 0.37 Allowed 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 120.603 0.24 . . . . 1.3 110.941 -177.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.488 ' HG ' ' N ' ' A' ' 60' ' ' ARG . 1.9 pt? -48.01 -38.78 17.89 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.529 -0.76 . . . . 2.1899999999999999 111.242 178.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.488 ' N ' ' HG ' ' A' ' 59' ' ' LEU . 66.0 mtt180 -54.67 -53.79 50.16 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.041 -0.527 . . . . 3.1400000000000001 111.034 -177.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.414 ' HE2' ' HB1' ' A' ' 102' ' ' ALA . 21.0 m-85 -85.25 -21.3 29.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.987 -0.551 . . . . 5.5899999999999999 110.678 -178.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.77 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 43.5 ttm180 -56.16 -28.5 58.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.12 -0.491 . . . . 4.9299999999999997 110.889 179.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.5 mmt180 -57.52 -55.6 32.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.77 -0.65 . . . . 5.3499999999999996 111.297 176.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.84 -32.78 15.2 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.996 0.739 . . . . 1.7 112.996 -173.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.824 ' HA ' ' HB2' ' A' ' 68' ' ' LEU . 0.3 OUTLIER -61.07 -25.44 66.94 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.813 0.671 . . . . 3.52 112.813 -166.566 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.4 m -63.66 -36.07 82.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.292 0.567 . . . . 2.5899999999999999 110.443 177.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -90.45 -32.41 16.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.493 -0.776 . . . . 2.7200000000000002 109.926 176.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.824 ' HB2' ' HA ' ' A' ' 65' ' ' PHE . 4.0 mp -64.67 -24.83 67.7 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 115.589 -0.732 . . . . 2.25 112.465 -178.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.806 HG21 HG13 ' A' ' 74' ' ' ILE . 2.5 p -61.38 -26.07 67.59 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.498 -0.481 . . . . 1.26 110.731 177.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 29.4 t -72.22 -39.35 68.59 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 109.248 -0.649 . . . . 1.8 109.248 172.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.811 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 9.1 mt-30 -63.62 -52.53 60.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.535 -0.757 . . . . 1.8899999999999999 110.299 178.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.689 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mp -67.5 -31.33 71.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.465 -0.789 . . . . 1.98 110.5 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 64.18 66.22 0.64 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 121.567 0.699 . . . . 3.54 109.464 -173.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.806 HG13 HG21 ' A' ' 69' ' ' THR . 25.3 mm -62.04 117.61 3.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.648 -1.16 . . . . 1.1499999999999999 110.426 178.341 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.75 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -159.57 -172.52 0.33 Allowed Pre-proline 0 C--N 1.316 -0.881 0 N-CA-C 107.723 -1.214 . . . . 1.1200000000000001 107.723 -169.481 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.75 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 38.2 Cg_exo -29.79 166.32 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.959 3.773 . . . . 0.53000000000000003 114.996 164.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.44 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.03 -29.3 0.01 OUTLIER Glycine 0 N--CA 1.475 1.279 0 N-CA-C 117.211 1.644 . . . . 0.40999999999999998 117.211 -175.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.448 ' N ' ' O ' ' A' ' 76' ' ' PRO . 23.9 p -67.71 1.23 2.6 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.949 0.874 . . . . 1.22 112.358 178.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.3 -13.93 61.62 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.101 0.476 . . . . 1.0700000000000001 110.125 171.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.423 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 53.5 t80 -75.28 -22.41 57.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.892 -0.595 . . . . 4.3099999999999996 109.581 175.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -82.7 -27.53 31.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.745 0.783 . . . . 1.03 109.608 174.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.47 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 6.5 m -69.91 -52.48 24.27 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.627 -1.17 . . . . 0.47999999999999998 109.515 172.096 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -66.47 -23.19 66.23 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.098 -0.955 . . . . 1.4399999999999999 110.088 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.562 ' HA ' HG22 ' A' ' 87' ' ' VAL . 30.1 tt0 -55.45 -48.7 74.08 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.159 0.504 . . . . 0.80000000000000004 110.739 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -47.12 -29.78 2.44 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.528 -1.214 . . . . 1.99 111.748 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.664 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.0 t -90.35 -49.77 13.42 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.131 0 CA-C-N 115.121 -0.945 . . . . 1.8999999999999999 110.199 -173.316 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.562 HG22 ' HA ' ' A' ' 84' ' ' GLU . 0.2 OUTLIER -52.45 -38.69 26.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 122.689 1.233 . . . . 1.4299999999999999 108.878 177.129 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.448 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 4.4 m-80 -62.65 -43.89 97.65 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 112.652 -2.067 . . . . 0.91000000000000003 112.16 -177.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 1.042 ' HB2' ' HB3' ' B' 1009 ' ' ALA . 1.3 pp20? -67.71 -34.51 77.02 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 122.092 0.949 . . . . 2.8700000000000001 108.967 177.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.614 HD11 ' OE2' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -66.9 -24.9 66.16 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-N 113.135 -1.848 . . . . 1.9199999999999999 111.399 -165.729 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.769 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 4.7 p90 -108.49 -35.56 6.45 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 120.329 -0.548 . . . . 2.9700000000000002 111.912 -172.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.448 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 10.3 ptm180 -75.31 -35.21 61.27 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.685 0.755 . . . . 5.6699999999999999 110.675 -171.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.4 ' HB3' HH12 ' A' ' 99' ' ' ARG . 13.6 t70 -87.59 4.27 44.38 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.827 -1.079 . . . . 3.1200000000000001 112.412 -169.431 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 129.67 70.13 0.12 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 117.375 -2.345 . . . . 2.3100000000000001 115.505 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.769 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 64.5 t -69.94 99.22 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-O 122.613 1.197 . . . . 1.6799999999999999 110.93 -179.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.721 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 0.2 OUTLIER -107.45 -179.03 3.8 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 113.402 -1.726 . . . . 2.1200000000000001 107.726 168.033 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.604 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 15.2 m-90 -49.7 -40.87 41.83 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 123.36 0.412 . . . . 4.1200000000000001 111.569 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -64.76 -41.01 97.8 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 114.574 0.59 . . . . 0.80000000000000004 114.574 -175.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.721 ' HG2' ' ND2' ' A' ' 96' ' ' ASN . 13.9 mmt85 -58.79 -43.27 90.42 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.21 0.529 . . . . 4.9100000000000001 111.123 -175.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 70.3 mt -68.89 -41.0 81.87 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.533 -0.758 . . . . 1.1100000000000001 110.622 -176.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 97' ' ' TRP . 63.0 t -54.45 -54.58 20.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.024 -0.535 . . . . 2.0299999999999998 109.856 171.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.414 ' HB1' ' HE2' ' A' ' 61' ' ' TYR . . . -52.33 -45.78 65.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.015 -0.993 . . . . 1.0600000000000001 111.384 177.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.607 ' HZ ' ' HA ' ' A' ' 130' ' ' MET . 42.5 t80 -55.21 -39.63 69.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.749 . . . . 1.8400000000000001 111.25 178.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.923 ' HZ ' HD13 ' A' ' 134' ' ' LEU . 27.0 m-85 -78.47 -35.69 46.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.683 0.278 . . . . 4.21 111.116 177.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.733 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 23.1 m -63.69 -47.47 81.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.241 -0.436 . . . . 1.55 110.658 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.417 ' HE1' ' HB2' ' A' ' 65' ' ' PHE . 50.1 t80 -81.74 -29.29 32.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.022 -0.536 . . . . 3.6400000000000001 110.618 -178.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.46 -47.72 61.3 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.769 -0.729 . . . . 0.32000000000000001 111.285 175.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.932 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -64.92 -28.59 73.66 Favored Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 111.466 -0.654 . . . . 0.23999999999999999 111.466 176.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.1 -32.75 61.51 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.295 -0.261 . . . . 1.05 110.295 176.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.415 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -68.29 -36.25 79.08 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-O 121.896 0.855 . . . . 1.78 109.494 -179.01 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.691 ' SG ' HG11 ' A' ' 123' ' ' VAL . 24.5 t -49.34 -50.88 37.8 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 113.77 -1.559 . . . . 0.90000000000000002 109.579 171.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.539 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 96.4 t -67.27 -34.43 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 115.634 -0.712 . . . . 1.2 110.945 177.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.6 ' HB3' HG22 ' A' ' 74' ' ' ILE . 7.8 mm-40 -59.87 -28.98 68.0 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.388 0.614 . . . . 2.5099999999999998 110.5 177.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.488 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 18.3 m -78.89 -39.61 34.53 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.347 -0.842 . . . . 0.28000000000000003 109.082 177.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.643 HG22 ' O ' ' A' ' 111' ' ' CYS . 96.4 t -67.37 -34.66 70.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.985 0.898 . . . . 1.8300000000000001 109.634 -177.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -54.78 -50.79 67.62 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.584 -1.644 . . . . 0.59999999999999998 111.25 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 24.6 mmtt -86.33 12.75 9.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.717 -0.674 . . . . 2.1600000000000001 110.055 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.39 52.07 4.98 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.87 0.843 . . . . 1.8799999999999999 110.971 -178.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.551 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 25.9 mtm -125.74 44.52 2.81 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.394 -1.276 . . . . 1.0800000000000001 107.883 178.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.447 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 5.8 mt-30 -60.02 -8.13 2.17 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.763 1.023 . . . . 1.1499999999999999 113.763 -173.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.551 HG23 HD22 ' A' ' 122' ' ' LEU . 27.1 m -66.81 -24.5 32.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 O-C-N 122.008 -0.432 . . . . 1.1899999999999999 110.904 175.394 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.767 HD12 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -71.3 -26.85 63.04 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 116.434 -0.348 . . . . 1.0600000000000001 110.338 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.691 HG11 ' SG ' ' A' ' 111' ' ' CYS . 69.1 t -46.86 -54.64 2.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 123.576 0.548 . . . . 1.0 111.64 178.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.571 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 2.5 t -70.79 -29.57 65.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.738 0.304 . . . . 1.6599999999999999 110.757 -179.161 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.767 ' HD2' HD12 ' A' ' 122' ' ' LEU . 73.8 mtt180 -69.31 -54.37 14.93 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.029 0.442 . . . . 3.2999999999999998 110.436 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.587 HG22 ' SD ' ' A' ' 130' ' ' MET . 73.0 mt -56.01 -52.02 54.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.618 -0.719 . . . . 1.0600000000000001 110.451 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.813 ' HB1' HD23 ' A' ' 13' ' ' LEU . . . -58.02 -33.73 69.27 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 120.889 0.376 . . . . 1.1000000000000001 111.599 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.541 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -62.21 -62.31 1.86 Allowed 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 121.124 0.488 . . . . 1.1200000000000001 110.379 176.283 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -62.07 -32.95 73.54 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.05 -0.977 . . . . 4.7699999999999996 111.617 -175.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.607 ' HA ' ' HZ ' ' A' ' 103' ' ' PHE . 88.9 mtp -61.63 -53.57 54.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.981 0.419 . . . . 1.0900000000000001 110.837 178.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.512 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -63.82 -39.07 93.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.046 -0.524 . . . . 1.05 110.982 179.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 86.3 m -63.66 -47.49 81.06 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.454 -0.339 . . . . 1.1299999999999999 111.074 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.443 ' CE2' HG11 ' A' ' 87' ' ' VAL . 52.2 t80 -57.21 -39.69 75.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.506 -0.315 . . . . 3.3500000000000001 110.403 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.942 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 4.8 tt -58.32 -54.26 49.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.365 -0.976 . . . . 1.5900000000000001 108.365 172.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -52.73 -46.31 67.35 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.229 -0.896 . . . . 0.46000000000000002 112.194 -177.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -80.13 -59.19 2.81 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.319 0.58 . . . . 0.58999999999999997 111.509 -176.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -92.62 -47.44 7.1 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 113.354 0.872 . . . . 2.3399999999999999 113.354 -168.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.942 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -80.25 -43.35 21.52 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 113.502 0.927 . . . . 1.8999999999999999 113.502 -166.636 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.654 ' HA ' HD11 ' A' ' 142' ' ' ILE . 32.9 tt0 -45.27 -53.11 18.65 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 112.919 0.711 . . . . 0.75 112.919 -175.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.52 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 19.6 Cg_endo -58.62 -45.29 30.66 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.693 1.595 . . . . 0.87 111.718 178.267 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -61.5 -42.58 99.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.419 -0.809 . . . . 1.4299999999999999 110.547 178.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.654 HD11 ' HA ' ' A' ' 139' ' ' GLU . 28.1 mt -52.11 -49.16 40.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.876 -0.602 . . . . 1.1299999999999999 110.83 174.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.61 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 71.1 mm-40 -63.06 -25.86 68.57 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.547 -0.751 . . . . 0.57999999999999996 111.324 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.6 mm-40 -68.15 -22.27 64.86 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.447 0.641 . . . . 0.78000000000000003 110.0 174.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.595 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -105.03 4.08 31.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.149 -0.932 . . . . 0.93000000000000005 109.785 -174.906 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 111.41 -43.28 1.75 Allowed Glycine 0 N--CA 1.442 -0.935 0 CA-C-N 115.385 -0.825 . . . . 0.56000000000000005 112.437 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . 0.557 ' HA2' HG21 ' A' ' 142' ' ' ILE . . . 128.6 -176.88 18.08 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.368 -0.92 . . . . 0.48999999999999999 112.808 178.284 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.659 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 8.5 m-90 -70.76 -38.48 73.46 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 122.683 0.393 . . . . 4.5199999999999996 110.843 -178.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -61.35 -45.05 96.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.938 0.399 . . . . 1.96 110.197 178.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.537 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 93.4 m -59.13 -35.41 73.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.853 -0.612 . . . . 1.24 111.477 178.037 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.604 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 88.4 t80 -60.96 -42.01 97.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.802 0.335 . . . . 3.7200000000000002 110.509 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.449 HG23 ' HB2' ' A' ' 45' ' ' ALA . 1.6 m -71.59 -25.09 24.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 1.8600000000000001 110.27 179.037 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.484 ' HB2' ' O ' ' A' ' 150' ' ' THR . 19.2 mm-40 -62.19 -30.36 71.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.88 0.371 . . . . 1.6699999999999999 110.33 171.409 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.7 mt -90.52 -62.05 1.54 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.135 -0.484 . . . . 1.96 110.941 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -123.64 29.65 6.5 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.451 0.643 . . . . 4.3899999999999997 110.721 -175.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.527 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -58.16 165.81 7.03 Favored Glycine 0 CA--C 1.499 -0.917 0 CA-C-N 115.474 -0.785 . . . . 1.1000000000000001 113.759 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . 0.458 ' CB ' ' HB3' ' A' ' 48' ' ' GLN . 27.4 t-20 . . . . . 0 C--N 1.307 -1.26 0 CA-C-N 113.888 -1.156 . . . . 1.29 110.837 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1005 ' ' GLY . . . . . 0.897 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.526 0.721 0 CA-C-O 120.99 0.216 . . . . 1.26 113.293 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1006 ' ' ARG . . . . . 0.826 ' HD3' ' H ' ' B' 1007 ' ' ALA . 0.0 OUTLIER -145.79 -29.56 0.42 Allowed 'General case' 0 C--O 1.215 -0.746 0 C-N-CA 122.787 0.435 . . . . 3.4500000000000002 110.344 175.888 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B 1007 ' ' ALA . . . . . 0.826 ' H ' ' HD3' ' B' 1006 ' ' ARG . . . -120.33 -27.3 5.26 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-N 115.984 -0.553 . . . . 1.54 110.708 -176.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.435 ' HG ' HG13 ' A' ' 86' ' ' VAL . 2.7 mm? -61.02 -46.77 89.39 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 106.069 -1.826 . . . . 1.8999999999999999 106.069 165.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 1.042 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . . . -53.97 -56.9 13.53 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 113.629 -1.623 . . . . 1.45 111.832 167.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B 1010 ' ' ALA . . . . . 0.652 ' HB1' ' HA ' ' B' 1007 ' ' ALA . . . -67.44 -54.33 21.2 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.165 -0.925 . . . . 1.51 112.908 -171.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 5.7 m-30 -66.0 -26.69 67.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.311 -0.404 . . . . 2.0699999999999998 110.131 -176.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -87.5 1.01 85.64 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.662 -0.699 . . . . 0.80000000000000004 113.458 -176.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 4.1 t70 -89.48 -3.21 58.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.162 0.506 . . . . 1.8999999999999999 110.246 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 3.2 m . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 115.949 -0.568 . . . . 1.4399999999999999 110.357 -179.488 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.1 mp0 . . . . . 0 CA--C 1.522 -0.125 0 CA-C-O 121.349 0.595 . . . . 2.7599999999999998 109.601 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.512 ' O ' HD13 ' A' ' 8' ' ' LEU . 1.5 p -68.66 -22.71 64.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.509 -0.769 . . . . 1.54 111.554 -178.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.487 ' HB3' HD22 ' A' ' 134' ' ' LEU . 3.1 p30 -62.72 -24.17 67.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.103 -0.499 . . . . 1.78 110.404 175.057 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.521 ' O ' HG22 ' A' ' 10' ' ' VAL . 3.9 tpp180 -61.53 -44.64 96.69 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.766 -0.652 . . . . 1.8999999999999999 109.832 174.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.479 ' HB3' ' HZ2' ' A' ' 47' ' ' LYS . 42.6 mt-10 -56.1 -57.85 10.4 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 115.554 -0.748 . . . . 0.68000000000000005 110.166 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.512 HD13 ' O ' ' A' ' 4' ' ' SER . 5.8 mp -41.53 -50.25 4.01 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.647 -1.161 . . . . 1.8 111.098 178.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.471 HG21 ' N ' ' A' ' 131' ' ' ALA . 79.0 t -64.66 -59.5 4.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.51 -0.313 . . . . 1.0700000000000001 111.04 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.521 HG22 ' O ' ' A' ' 6' ' ' ARG . 85.4 t -54.13 -48.14 65.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.135 -0.484 . . . . 1.1299999999999999 112.122 -175.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -51.09 -43.83 61.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.93 -0.577 . . . . 0.58999999999999997 110.808 -177.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.633 ' HB2' ' CE2' ' A' ' 104' ' ' PHE . 6.1 t80 -81.59 -41.34 21.69 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.19 -0.459 . . . . 2.02 111.679 -175.118 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 1.0 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 3.8 mp -60.46 -40.21 90.39 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 119.771 -0.772 . . . . 1.0600000000000001 109.745 178.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.468 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 48.5 t -64.07 -46.5 84.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.673 -0.694 . . . . 1.6000000000000001 110.067 175.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -60.36 -32.22 71.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.518 -0.764 . . . . 1.49 110.9 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.676 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 6.4 mmpt? -75.61 -33.19 60.51 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 111.839 0.311 . . . . 1.8400000000000001 111.839 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.599 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -62.22 -27.72 69.19 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.736 -0.786 . . . . 1.98 109.788 175.163 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.9 t -65.61 -30.33 71.04 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.379 -0.828 . . . . 1.3799999999999999 112.219 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.676 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 13.4 pt20 -74.92 -9.24 58.36 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.773 0.657 . . . . 1.51 112.773 -172.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.748 ' NZ ' HG11 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -119.24 -19.94 8.14 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 121.918 0.866 . . . . 2.6499999999999999 109.549 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.51 26.4 6.89 Favored Glycine 0 C--N 1.306 -1.086 0 CA-C-N 113.945 -1.48 . . . . 0.54000000000000004 113.058 173.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -104.98 171.23 7.43 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.612 0.244 . . . . 1.1200000000000001 110.555 170.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.588 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 8.3 t -110.67 157.63 19.51 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.104 0.478 . . . . 0.75 110.861 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.524 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 65.6 t-105 -75.92 -52.05 11.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.516 -0.766 . . . . 4.29 110.172 174.041 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m -67.21 -19.91 65.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.579 -0.737 . . . . 1.8600000000000001 111.685 -174.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.588 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 51.3 mt-30 -51.93 -38.7 57.36 Favored 'General case' 0 N--CA 1.461 0.092 0 N-CA-C 111.793 0.294 . . . . 1.52 111.793 177.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -121.93 -4.15 9.11 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.831 0.678 . . . . 1.53 112.831 -178.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.406 ' HB3' HG23 ' A' ' 30' ' ' VAL . 19.8 m -102.16 149.23 24.49 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 122.026 0.917 . . . . 2.04 112.094 -178.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -124.37 -1.71 8.09 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 113.594 -1.639 . . . . 2.3100000000000001 109.015 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.627 HG22 ' H ' ' A' ' 31' ' ' GLU . 4.6 m -58.75 -73.7 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 113.889 -1.505 . . . . 1.4099999999999999 112.801 -168.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.627 ' H ' HG22 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -90.73 0.06 57.54 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.481 0.658 . . . . 2.7400000000000002 109.868 177.262 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 . . . . . 0 N--CA 1.447 -0.586 0 CA-C-N 114.774 -1.103 . . . . 1.45 110.857 179.339 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.703 HG21 ' H ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.308 0 N-CA-C 110.28 -0.267 . . . . 1.45 110.28 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.703 ' H ' HG21 ' A' ' 41' ' ' THR . 14.3 pt-20 -93.85 -31.24 14.42 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.011 0.91 . . . . 2.02 109.892 173.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.73 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 57.7 m -63.66 -25.11 68.07 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 113.653 -1.612 . . . . 1.25 113.261 -170.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -40.12 -50.8 2.65 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 123.613 0.571 . . . . 1.9099999999999999 112.314 -173.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.82 -40.05 41.75 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.931 -0.308 . . . . 1.1799999999999999 111.652 176.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.641 ' HB ' ' HB3' ' A' ' 148' ' ' TRP . 1.9 m -65.12 -46.13 92.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 121.284 -0.166 . . . . 2.0099999999999998 111.381 -176.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.73 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.8 ptpt -68.34 -40.27 81.64 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.457 -0.571 . . . . 1.3799999999999999 109.457 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.682 HE21 ' HA ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -58.34 -38.4 77.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.414 -0.812 . . . . 0.98999999999999999 111.086 174.882 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.455 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -72.06 -41.57 67.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.4 0.619 . . . . 1.1399999999999999 110.981 176.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.547 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.1 tp -65.98 -24.83 66.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.318 -0.856 . . . . 1.95 112.087 -174.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.607 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 7.6 ptp180 -85.63 -25.91 26.34 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 121.705 0.764 . . . . 2.5099999999999998 109.491 -177.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.789 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 7.5 mm-40 -69.57 -47.54 63.26 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.705 -1.134 . . . . 1.1000000000000001 109.282 173.025 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 56' ' ' GLU . . . -66.81 -33.19 75.07 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.084 -0.962 . . . . 1.04 110.173 174.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.652 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -59.06 -46.44 93.74 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.371 -0.692 . . . . 0.69999999999999996 111.371 176.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.623 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 30.4 t70 -63.26 -37.29 86.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.963 0.411 . . . . 1.04 110.283 176.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.447 ' HB3' ' O ' ' A' ' 53' ' ' ALA . 14.6 tp10 -60.48 -28.15 68.12 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.34 -0.845 . . . . 2.29 110.469 176.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.692 ' HZ ' ' HB3' ' B' 1008 ' ' LEU . 49.8 t80 -81.9 -46.56 13.9 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.322 -0.854 . . . . 2.9300000000000002 110.771 174.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.737 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 46.3 mt-10 -60.13 -57.67 11.8 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.504 -0.771 . . . . 1.3 112.76 -170.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.66 HD13 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -43.32 -41.47 4.06 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.853 1.057 . . . . 2.1899999999999999 113.853 -172.851 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.66 ' H ' HD13 ' A' ' 59' ' ' LEU . 72.5 mtt85 -67.81 -45.71 73.96 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.011 0.374 . . . . 3.1400000000000001 112.011 -175.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.737 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 5.0 p90 -92.42 -3.87 54.59 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.731 -0.213 . . . . 5.5899999999999999 111.159 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.9 tpp180 -43.36 -49.52 6.94 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.361 0.664 . . . . 4.9299999999999997 112.578 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -67.21 -13.51 62.03 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.209 0.448 . . . . 5.3499999999999996 112.209 -175.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.484 ' O ' HD12 ' A' ' 68' ' ' LEU . . . -92.14 -26.6 18.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.842 0.312 . . . . 1.7 111.842 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.602 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 81.3 t80 -48.96 -46.45 43.48 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.078 0.77 . . . . 3.52 113.078 -170.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.8 t -68.03 -40.14 82.96 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.913 0.387 . . . . 2.5899999999999999 110.896 -175.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -71.2 -39.45 71.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.049 -0.523 . . . . 2.7200000000000002 111.006 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.484 HD12 ' O ' ' A' ' 64' ' ' ALA . 3.7 mp -64.81 -20.46 66.4 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 113.211 0.819 . . . . 2.25 113.211 -171.121 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.537 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 3.2 p -57.45 -35.49 70.19 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.064 0.847 . . . . 1.26 111.16 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.0 t -71.93 -25.36 61.86 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.54 -0.754 . . . . 1.8 109.528 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.479 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 9.2 mt-30 -83.82 -38.01 21.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.223 -0.898 . . . . 1.8899999999999999 110.133 -178.524 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.562 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.8 mm? -65.96 -32.99 74.8 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.734 -0.469 . . . . 1.98 109.734 170.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.44 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 50.6 m80 68.16 41.77 1.89 Allowed 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.144 -1.058 . . . . 3.54 108.144 -173.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.591 HG21 ' HE3' ' A' ' 119' ' ' MET . 28.0 mm -50.44 117.15 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 113.322 -1.763 . . . . 1.1499999999999999 111.931 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.761 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.46 -171.48 0.28 Allowed Pre-proline 0 N--CA 1.441 -0.913 0 N-CA-C 107.43 -1.322 . . . . 1.1200000000000001 107.43 -173.097 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.761 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.7 Cg_exo -28.86 166.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 125.017 3.811 . . . . 0.53000000000000003 115.355 164.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.527 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -29.09 -28.75 0.01 OUTLIER Glycine 0 N--CA 1.472 1.074 0 N-CA-C 117.937 1.935 . . . . 0.40999999999999998 117.937 -170.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.471 ' N ' ' O ' ' A' ' 76' ' ' PRO . 41.7 p -66.72 5.8 0.57 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 118.31 1.055 . . . . 1.22 112.339 -178.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.401 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -69.9 -12.43 61.61 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.975 0.417 . . . . 1.0700000000000001 110.096 174.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.527 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 10.4 p90 -76.33 -17.3 59.49 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.427 0.632 . . . . 4.3099999999999996 109.349 174.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.431 ' HB2' ' O ' ' A' ' 78' ' ' THR . 35.7 mt-30 -84.91 -20.02 31.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.101 -0.954 . . . . 1.03 109.698 174.015 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.0 m -82.04 -53.28 6.25 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.531 -1.213 . . . . 0.47999999999999998 109.667 173.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.782 ' HA ' HG22 ' A' ' 86' ' ' VAL . 78.3 t80 -63.09 -16.68 60.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.326 -0.852 . . . . 1.4399999999999999 110.111 174.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.535 ' HA ' HG13 ' A' ' 87' ' ' VAL . 40.3 tt0 -54.68 -50.23 68.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.205 -0.907 . . . . 0.80000000000000004 110.374 173.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -49.94 -32.15 14.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.986 -1.006 . . . . 1.99 110.888 177.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.847 HG11 HD13 ' B' 1008 ' ' LEU . 1.8 t -80.93 -53.49 12.31 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-N 114.733 -1.121 . . . . 1.8999999999999999 110.443 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.535 HG13 ' HA ' ' A' ' 84' ' ' GLU . 8.9 p -60.98 -23.55 30.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.815 0.817 . . . . 1.4299999999999999 109.337 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.6 m-80 -78.06 -38.87 43.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.338 -1.301 . . . . 0.91000000000000003 112.089 176.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 1.123 ' HB2' ' HB1' ' B' 1009 ' ' ALA . 1.0 OUTLIER -73.84 -32.38 63.65 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.343 -0.984 . . . . 2.8700000000000001 108.343 178.805 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.624 HD11 ' OE2' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -67.61 -44.02 79.06 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.553 -1.203 . . . . 1.9199999999999999 110.233 -174.059 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -99.14 10.18 41.96 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.496 -0.774 . . . . 2.9700000000000002 111.066 -169.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.852 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.09 -23.47 66.54 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.108 -0.496 . . . . 5.6699999999999999 110.542 178.301 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -96.44 -31.11 12.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 122.068 0.937 . . . . 3.1200000000000001 109.186 169.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.563 ' O ' HG21 ' A' ' 95' ' ' VAL . . . 130.79 -42.1 1.44 Allowed Glycine 0 C--N 1.312 -0.79 0 CA-C-N 113.862 -1.517 . . . . 2.3100000000000001 113.234 165.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.592 HG23 ' CD2' ' A' ' 138' ' ' LEU . 1.6 t 168.2 131.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 C-N-CA 125.079 1.352 . . . . 1.6799999999999999 110.582 157.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.555 ' H ' ' CB ' ' A' ' 99' ' ' ARG . 2.0 m120 -111.16 170.07 8.35 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.387 -0.824 . . . . 2.1200000000000001 109.313 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.547 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 16.9 m-90 -54.76 -58.05 9.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.933 0.396 . . . . 4.1200000000000001 110.713 175.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.424 ' O ' HG11 ' A' ' 101' ' ' VAL . . . -70.2 -13.94 70.79 Favored Glycine 0 CA--C 1.518 0.272 0 CA-C-N 115.93 -0.577 . . . . 0.80000000000000004 112.689 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.555 ' CB ' ' H ' ' A' ' 96' ' ' ASN . 18.2 tpp180 -69.35 -43.2 74.1 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.078 0.466 . . . . 4.9100000000000001 110.97 -176.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 90.2 mt -64.67 -40.26 88.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.731 -0.668 . . . . 1.1100000000000001 110.547 -178.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.551 ' O ' ' HD1' ' A' ' 104' ' ' PHE . 0.5 OUTLIER -63.97 -38.19 81.76 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 CA-C-N 116.204 -0.453 . . . . 2.0299999999999998 110.322 175.592 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.1 -46.44 89.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.354 0.597 . . . . 1.0600000000000001 110.217 176.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.42 ' HA ' HD22 ' A' ' 90' ' ' LEU . 36.7 t80 -58.22 -50.0 75.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.81 -1.087 . . . . 1.8400000000000001 111.284 177.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.875 ' HA ' ' HE1' ' A' ' 130' ' ' MET . 0.0 OUTLIER -76.49 -20.04 57.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.808 0.337 . . . . 4.21 110.948 -176.32 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.601 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 37.3 t -75.67 -55.98 5.13 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.261 -0.427 . . . . 1.55 110.304 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -66.49 -26.66 67.28 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 109.448 -0.575 . . . . 3.6400000000000001 109.448 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.548 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.11 -38.53 95.42 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 121.09 -0.576 . . . . 0.32000000000000001 111.735 174.036 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 1.0 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -68.77 -35.4 79.93 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.587 -0.816 . . . . 0.23999999999999999 111.076 174.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.602 ' HB2' ' CE1' ' A' ' 65' ' ' PHE . . . -67.81 -33.3 74.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.366 -0.417 . . . . 1.05 110.627 176.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.439 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -60.93 -37.42 82.25 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 122.221 1.01 . . . . 1.78 108.708 -178.854 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.628 ' SG ' HG13 ' A' ' 123' ' ' VAL . 35.3 t -58.69 -53.74 54.98 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.038 -1.437 . . . . 0.90000000000000002 110.148 174.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.748 HG11 ' NZ ' ' A' ' 20' ' ' LYS . 80.7 t -60.18 -40.79 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 116.619 -0.264 . . . . 1.2 110.914 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.537 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 35.6 mt-10 -54.45 -38.22 66.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.011 0.434 . . . . 2.5099999999999998 110.611 176.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 48.0 m -74.38 -38.78 63.06 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.491 0.663 . . . . 0.28000000000000003 109.543 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.627 HG22 ' O ' ' A' ' 111' ' ' CYS . 92.0 t -69.31 -30.31 45.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.114 -0.948 . . . . 1.8300000000000001 109.783 -177.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.81 -49.79 74.32 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 113.641 -1.618 . . . . 0.59999999999999998 111.027 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.44 ' CG ' ' HE2' ' A' ' 119' ' ' MET . 25.8 mmtt -87.4 11.96 13.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.439 -0.801 . . . . 2.1600000000000001 110.278 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 61.32 50.9 4.49 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 122.044 0.926 . . . . 1.8799999999999999 110.556 -178.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.591 ' HE3' HG21 ' A' ' 74' ' ' ILE . 24.3 mtm -125.63 46.91 2.3 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.255 -1.339 . . . . 1.0800000000000001 107.565 176.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.624 ' HG2' ' HA ' ' A' ' 115' ' ' VAL . 27.8 mt-30 -68.44 -5.79 21.19 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.083 -0.962 . . . . 1.1499999999999999 111.142 -172.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.641 HG23 HD21 ' A' ' 122' ' ' LEU . 25.8 m -58.02 -24.65 24.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 122.142 -0.349 . . . . 1.1899999999999999 110.895 172.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.7 HD12 ' HD2' ' A' ' 125' ' ' ARG . 3.0 mm? -76.06 -26.8 56.9 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.481 -0.327 . . . . 1.0600000000000001 110.391 178.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.628 HG13 ' SG ' ' A' ' 111' ' ' CYS . 78.8 t -45.63 -57.62 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 O-C-N 123.806 0.691 . . . . 1.0 111.707 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -21.45 57.62 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.787 -0.642 . . . . 1.6599999999999999 111.639 -176.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.7 ' HD2' HD12 ' A' ' 122' ' ' LEU . 86.7 mtt180 -72.35 -58.22 3.57 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.924 -0.58 . . . . 3.2999999999999998 110.385 175.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.624 ' HA ' ' CE2' ' A' ' 129' ' ' TRP . 86.9 mt -48.25 -49.41 12.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.426 -0.806 . . . . 1.0600000000000001 111.595 -176.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.524 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -59.64 -26.3 65.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.09 0.404 . . . . 1.1000000000000001 112.09 -177.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.18 -65.13 0.71 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.496 0.665 . . . . 1.1200000000000001 110.046 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.624 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 38.7 p-90 -75.16 -17.85 60.31 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.04 -0.982 . . . . 4.7699999999999996 111.747 -175.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.875 ' HE1' ' HA ' ' A' ' 104' ' ' PHE . 13.3 mmm -62.21 -57.67 10.59 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 120.967 0.413 . . . . 1.0900000000000001 110.248 170.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.471 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -64.0 -38.29 90.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.883 -0.598 . . . . 1.05 110.538 179.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.488 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 89.1 m -60.78 -43.56 97.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.399 -0.364 . . . . 1.1299999999999999 111.534 176.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -60.88 -39.9 90.99 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.775 -0.454 . . . . 3.3500000000000001 109.775 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.487 HD22 ' HB3' ' A' ' 5' ' ' ASN . 5.4 tt -62.18 -50.87 70.1 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.603 -0.888 . . . . 1.5900000000000001 108.603 173.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -48.69 -56.74 7.69 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.977 -0.556 . . . . 0.46000000000000002 112.41 179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -78.06 -49.74 13.4 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.043 0.449 . . . . 0.58999999999999997 111.88 -174.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -91.3 -50.81 5.61 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 112.788 0.662 . . . . 2.3399999999999999 112.788 -169.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.592 ' CD2' HG23 ' A' ' 95' ' ' VAL . 53.7 mt -86.29 -34.68 20.28 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 112.729 0.64 . . . . 1.8999999999999999 112.729 -166.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.62 ' HA ' HD11 ' A' ' 142' ' ' ILE . 21.0 tt0 -49.84 -51.39 61.09 Favored Pre-proline 0 CA--C 1.539 0.545 0 O-C-N 123.198 0.311 . . . . 0.75 111.707 -174.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.567 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 24.6 Cg_exo -63.42 -43.3 18.32 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 121.934 1.756 . . . . 0.87 111.951 176.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 5.6 t-105 -59.45 -47.35 85.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.418 -0.81 . . . . 1.4299999999999999 110.223 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.62 HD11 ' HA ' ' A' ' 139' ' ' GLU . 37.4 mt -48.39 -51.58 10.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.592 -0.731 . . . . 1.1299999999999999 111.095 174.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.618 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 70.1 mm-40 -57.15 -35.25 69.29 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.718 -0.673 . . . . 0.57999999999999996 111.303 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 9.5 mm-40 -64.8 -21.54 66.8 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.437 0.637 . . . . 0.78000000000000003 111.307 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -110.65 9.21 22.91 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.256 -0.884 . . . . 0.93000000000000005 110.105 -174.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 116.43 -47.52 1.03 Allowed Glycine 0 N--CA 1.441 -1.029 0 CA-C-N 114.78 -1.1 . . . . 0.56000000000000005 112.704 174.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . 0.563 ' HA2' HG21 ' A' ' 142' ' ' ILE . . . 132.01 -177.24 18.82 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.761 -0.733 . . . . 0.48999999999999999 111.961 -177.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.641 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 13.6 m-90 -71.01 -37.95 72.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.019 0.438 . . . . 4.5199999999999996 110.258 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.6 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 6.2 m-20 -64.07 -31.49 72.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.638 -0.71 . . . . 1.96 110.339 178.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.578 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 87.0 m -67.34 -40.04 85.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.068 -0.515 . . . . 1.24 111.508 179.348 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.547 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 85.3 t80 -64.72 -31.06 72.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.797 0.808 . . . . 3.7200000000000002 109.104 -178.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.6 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 87.4 t -59.67 -50.24 80.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 114.422 -1.263 . . . . 1.8600000000000001 110.35 172.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.79 -28.45 64.01 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.829 -1.078 . . . . 1.6699999999999999 111.518 176.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 150' ' ' THR . 10.2 mt -86.37 -56.13 3.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.458 -0.337 . . . . 1.96 111.26 -177.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -115.11 -44.25 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.871 -0.332 . . . . 4.3899999999999997 110.461 -178.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.466 ' HA2' ' HA ' ' A' ' 152' ' ' VAL . . . 50.86 -160.17 1.61 Allowed Glycine 0 CA--C 1.509 -0.343 0 CA-C-O 121.813 0.674 . . . . 1.1000000000000001 114.597 178.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . 0.789 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 23.9 t-20 . . . . . 0 N--CA 1.433 -1.289 0 CA-C-N 114.37 -0.915 . . . . 1.29 110.197 -177.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.998 0 N-CA-C 114.026 0.371 . . . . 1.26 114.026 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -102.63 -48.5 4.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.951 0.405 . . . . 3.4500000000000002 111.125 174.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -63.23 -53.88 46.06 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.913 0.709 . . . . 1.54 112.913 -169.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.847 HD13 HG11 ' A' ' 86' ' ' VAL . 3.1 mt -72.55 -40.41 66.72 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.335 -0.617 . . . . 1.8999999999999999 109.335 -171.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 1.123 ' HB1' ' HB2' ' A' ' 89' ' ' GLU . . . -47.73 -49.97 26.63 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 122.212 1.006 . . . . 1.45 109.92 169.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -69.14 -49.42 57.09 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 113.82 -1.537 . . . . 1.51 111.997 -175.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -68.4 -23.76 64.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.238 -0.437 . . . . 2.0699999999999998 111.161 -176.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -68.18 -23.81 74.72 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 116.062 -0.517 . . . . 0.80000000000000004 113.639 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.62 -2.87 12.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.274 0.472 . . . . 1.8999999999999999 112.274 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 32.8 m . . . . . 0 C--N 1.327 -0.406 0 N-CA-C 111.901 0.334 . . . . 1.4399999999999999 111.901 -178.728 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 . . . . . 0 C--O 1.232 0.181 0 CA-C-O 121.579 0.704 . . . . 2.7599999999999998 109.707 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.41 ' HB3' ' OG ' ' A' ' 43' ' ' SER . 1.4 m -64.64 -26.47 68.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.071 -0.968 . . . . 1.54 112.208 -174.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.577 ' HB2' HD13 ' A' ' 134' ' ' LEU . 5.2 p30 -66.39 -28.56 68.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.674 0.274 . . . . 1.78 111.483 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.634 ' O ' HG23 ' A' ' 10' ' ' VAL . 7.2 tpp180 -56.99 -46.14 82.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.021 -0.536 . . . . 1.8999999999999999 110.113 177.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.468 ' OE1' ' HB2' ' A' ' 43' ' ' SER . 44.1 mt-10 -55.18 -49.71 71.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.123 -0.944 . . . . 0.68000000000000005 111.367 -178.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.487 HD22 HG22 ' A' ' 46' ' ' VAL . 9.0 mt -58.7 -35.83 73.27 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.936 -1.029 . . . . 1.8 110.271 -173.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.44 HG22 ' N ' ' A' ' 131' ' ' ALA . 75.8 t -70.97 -58.94 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.558 -0.747 . . . . 1.0700000000000001 109.985 174.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.634 HG23 ' O ' ' A' ' 6' ' ' ARG . 86.5 t -52.88 -55.62 11.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.864 -1.062 . . . . 1.1299999999999999 112.243 -174.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.42 -36.35 71.24 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.142 -0.481 . . . . 0.58999999999999997 110.385 -177.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.687 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 5.7 t80 -70.45 -49.38 49.24 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.847 -0.615 . . . . 2.02 110.573 -178.49 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.972 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.0 mp -62.11 -38.64 89.66 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 120.558 -0.457 . . . . 1.0600000000000001 110.489 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.409 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 28.6 t -55.65 -46.34 77.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.883 -0.599 . . . . 1.6000000000000001 110.403 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -69.04 -29.07 67.14 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.896 -0.593 . . . . 1.49 110.85 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.627 ' HG2' ' O ' ' A' ' 12' ' ' PHE . 10.0 mmpt? -71.71 -37.42 70.66 Favored 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 121.057 -0.257 . . . . 1.8400000000000001 110.709 -179.06 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.463 HD21 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -66.64 -30.73 71.06 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.943 -0.391 . . . . 1.98 109.943 174.761 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.0 t -64.05 -25.55 68.16 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.978 -0.556 . . . . 1.3799999999999999 111.451 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -72.68 -18.53 61.54 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.863 0.84 . . . . 1.51 110.095 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.552 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.0 mmmt -104.83 -26.36 12.26 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.249 -1.341 . . . . 2.6499999999999999 109.281 -175.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.35 26.53 7.7 Favored Glycine 0 N--CA 1.438 -1.193 0 CA-C-N 113.815 -1.539 . . . . 0.54000000000000004 111.433 178.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.666 ' HB3' ' HE2' ' A' ' 27' ' ' PHE . 96.0 m-85 -115.46 166.82 11.46 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.335 -0.432 . . . . 1.1200000000000001 110.298 177.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.9 t -110.8 145.76 37.59 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.274 -0.421 . . . . 0.75 110.632 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.413 ' CE2' HG11 ' A' ' 10' ' ' VAL . 1.7 t90 -68.88 -49.99 53.52 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.248 -0.433 . . . . 4.29 109.897 174.42 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.8 p -61.77 -37.46 84.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.642 -0.708 . . . . 1.8600000000000001 111.45 -173.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -58.88 -28.75 66.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.209 -0.451 . . . . 1.52 111.477 178.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.666 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 17.4 m-85 -117.04 16.31 15.04 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.035 0.445 . . . . 1.53 110.726 -175.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.61 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 78.9 p -100.46 179.52 4.42 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.4 0.619 . . . . 2.04 111.814 -174.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.622 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 14.3 t70 -167.05 -13.17 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.399 -1.273 . . . . 2.3100000000000001 108.515 -178.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.598 HG22 ' H ' ' A' ' 31' ' ' GLU . 9.0 m -67.48 -72.0 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.232 -1.349 . . . . 1.4099999999999999 111.707 179.085 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.598 ' H ' HG22 ' A' ' 30' ' ' VAL . 28.4 mm-40 -94.48 2.54 55.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.846 -0.798 . . . . 2.7400000000000002 108.846 177.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.622 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 6.2 tt0 . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 114.8 -1.091 . . . . 1.45 111.084 -177.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.87 HG21 ' H ' ' A' ' 42' ' ' GLU . 2.6 t . . . . . 0 N--CA 1.448 -0.525 0 N-CA-C 109.931 -0.396 . . . . 1.45 109.931 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.87 ' H ' HG21 ' A' ' 41' ' ' THR . 14.5 pt-20 -93.32 -31.66 14.59 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.618 1.199 . . . . 2.02 108.631 166.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.893 ' HA ' HG11 ' A' ' 46' ' ' VAL . 39.4 m -68.94 -17.21 63.92 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 113.071 -1.877 . . . . 1.25 114.68 -167.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -52.82 -39.82 62.76 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 118.439 0.563 . . . . 1.9099999999999999 111.001 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -82.08 -40.38 22.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.592 -0.276 . . . . 1.1799999999999999 111.205 176.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.893 HG11 ' HA ' ' A' ' 43' ' ' SER . 1.8 m -69.43 -36.95 74.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.896 -0.321 . . . . 2.0099999999999998 111.313 -175.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -71.27 -34.94 71.15 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 108.776 -0.824 . . . . 1.3799999999999999 108.776 178.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.536 ' NE2' ' HD3' ' A' ' 51' ' ' ARG . 4.3 mm100 -64.21 -32.88 74.63 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.161 -0.927 . . . . 0.98999999999999999 110.42 177.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.615 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -77.42 -42.44 36.13 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.886 -0.597 . . . . 1.1399999999999999 110.779 175.511 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.482 HD13 ' CE2' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -66.51 -23.13 66.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.001 -0.545 . . . . 1.95 112.242 -176.387 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.536 ' HD3' ' NE2' ' A' ' 48' ' ' GLN . 16.2 ptm180 -78.12 -29.13 48.72 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 107.863 -1.162 . . . . 2.5099999999999998 107.863 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.903 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 6.6 mm-40 -74.42 -52.13 12.93 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 113.565 -1.652 . . . . 1.1000000000000001 109.835 177.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.07 -44.39 92.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.823 -0.626 . . . . 1.04 111.025 178.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.564 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.86 -36.04 92.84 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 121.045 -0.598 . . . . 0.69999999999999996 111.984 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.41 ' O ' HD11 ' A' ' 59' ' ' LEU . 22.0 t70 -64.33 -37.11 86.34 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 110.34 -0.245 . . . . 1.04 110.34 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.569 ' HA ' HD12 ' A' ' 59' ' ' LEU . 24.3 mm-40 -60.5 -27.06 67.3 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.544 0.528 . . . . 2.29 111.292 177.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.573 ' HD2' ' HB3' ' A' ' 105' ' ' SER . 36.8 t80 -80.33 -26.4 38.77 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.986 0.422 . . . . 2.9300000000000002 110.271 175.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.564 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 46.4 mt-10 -67.94 -60.78 2.24 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.933 -0.576 . . . . 1.3 111.951 -174.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.62 HD23 ' N ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -55.71 -33.76 64.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 118.18 0.445 . . . . 2.1899999999999999 110.995 -178.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.62 ' N ' HD23 ' A' ' 59' ' ' LEU . 59.7 mtt180 -60.22 -62.65 1.71 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.759 -0.655 . . . . 3.1400000000000001 112.049 172.333 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.676 ' HH ' HD22 ' A' ' 68' ' ' LEU . 6.0 t80 -92.71 -2.98 55.58 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.339 0.866 . . . . 5.5899999999999999 113.339 -168.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.856 ' HA ' ' CE2' ' A' ' 65' ' ' PHE . 32.6 ttt180 -52.81 -45.61 67.31 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.895 0.702 . . . . 4.9299999999999997 112.895 -171.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -69.56 -14.04 62.64 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.964 -0.294 . . . . 5.3499999999999996 111.212 -178.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.671 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.35 -60.77 1.84 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.012 0.375 . . . . 1.7 112.012 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.856 ' CE2' ' HA ' ' A' ' 62' ' ' ARG . 4.9 p90 -57.88 -29.45 65.04 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.751 1.019 . . . . 3.52 113.751 -167.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.3 t -90.74 -11.33 39.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.312 0.577 . . . . 2.5899999999999999 110.43 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -90.8 -50.97 5.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.779 0.8 . . . . 2.7200000000000002 110.413 -177.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 1.061 HD12 HD11 ' A' ' 72' ' ' LEU . 0.4 OUTLIER -67.44 -4.29 10.85 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.357 -1.292 . . . . 2.25 114.4 -174.372 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.723 HG21 HG13 ' A' ' 74' ' ' ILE . 3.2 p -45.78 -23.75 0.3 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 118.779 0.718 . . . . 1.26 112.86 -171.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 73.7 m -46.48 -60.15 2.53 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.1 0.56 . . . . 1.8 111.508 166.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.646 HE21 ' CB ' ' A' ' 68' ' ' LEU . 2.0 mp0 -47.79 -51.5 22.27 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 124.441 1.097 . . . . 1.8899999999999999 111.39 176.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 1.061 HD11 HD12 ' A' ' 68' ' ' LEU . 2.9 mp -77.59 -19.82 54.97 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.236 -1.347 . . . . 1.98 111.339 -166.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.9 t-80 54.54 50.0 17.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.817 0.818 . . . . 3.54 109.103 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.723 HG13 HG21 ' A' ' 69' ' ' THR . 30.9 mm -57.44 105.67 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 114.113 -1.403 . . . . 1.1499999999999999 111.33 -177.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.754 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.91 -169.55 0.22 Allowed Pre-proline 0 C--N 1.315 -0.913 0 N-CA-C 107.022 -1.473 . . . . 1.1200000000000001 107.022 -169.146 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.754 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 65.9 Cg_exo -28.92 165.38 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 124.674 3.583 . . . . 0.53000000000000003 115.236 164.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.648 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -28.72 -32.67 0.01 OUTLIER Glycine 0 N--CA 1.469 0.834 0 N-CA-C 117.523 1.769 . . . . 0.40999999999999998 117.523 -171.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.443 ' N ' ' O ' ' A' ' 76' ' ' PRO . 37.3 p -64.43 3.67 0.45 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 118.125 0.962 . . . . 1.22 112.618 -176.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.1 -14.36 62.96 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.235 0.54 . . . . 1.0700000000000001 109.608 171.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.648 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 13.3 p90 -72.66 -20.81 61.18 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.791 -0.64 . . . . 4.3099999999999996 109.44 175.115 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.535 HE21 ' HH ' ' A' ' 80' ' ' TYR . 57.0 mt-30 -79.08 -30.05 43.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.442 0.639 . . . . 1.03 109.854 177.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -70.55 -49.17 50.82 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.9 -1.045 . . . . 0.47999999999999998 109.263 173.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.413 ' O ' HG11 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -68.72 -16.69 63.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.053 -1.431 . . . . 1.4399999999999999 110.773 176.264 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.587 ' HA ' HG11 ' A' ' 87' ' ' VAL . 40.5 tt0 -70.71 -52.43 21.0 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.086 -0.507 . . . . 0.80000000000000004 110.809 178.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 81' ' ' GLN . 58.4 mt-30 -45.64 -40.53 9.16 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 114.802 -1.09 . . . . 1.99 111.207 -179.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.908 ' HA ' ' HA2' ' B' 1005 ' ' GLY . 1.2 p -86.47 -47.71 16.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-N 113.55 -1.659 . . . . 1.8999999999999999 111.697 -173.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.587 HG11 ' HA ' ' A' ' 84' ' ' GLU . 8.1 p -61.95 -24.95 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.882 0.849 . . . . 1.4299999999999999 109.835 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.438 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 0.6 OUTLIER -62.11 -44.83 95.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.266 -1.334 . . . . 0.91000000000000003 110.629 178.518 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.824 ' HB3' ' HB1' ' B' 1009 ' ' ALA . 7.9 mm-40 -71.66 -37.92 70.73 Favored 'General case' 0 CA--C 1.495 -1.164 0 CA-C-O 121.719 0.771 . . . . 2.8700000000000001 109.758 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' A' ' 87' ' ' VAL . 16.3 mt -59.78 -19.03 47.95 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 113.781 -1.554 . . . . 1.9199999999999999 111.884 -172.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.639 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 84.9 t80 -105.04 -35.58 7.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.51 0.672 . . . . 2.9700000000000002 111.489 -177.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.438 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 8.4 ptm180 -84.0 -36.41 23.18 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.863 -0.608 . . . . 5.6699999999999999 111.471 -172.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -95.85 21.21 8.83 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.901 -0.59 . . . . 3.1200000000000001 112.58 -170.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.19 68.41 0.11 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 117.665 -2.207 . . . . 2.3100000000000001 115.814 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.639 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 60.8 t -74.98 102.1 2.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 118.599 1.2 . . . . 1.6799999999999999 111.243 174.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.447 HD21 ' HB2' ' A' ' 99' ' ' ARG . 0.3 OUTLIER -111.54 -173.18 2.19 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.547 -1.206 . . . . 2.1200000000000001 108.402 173.072 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.575 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 7.5 m95 -61.98 -55.31 30.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.707 0.289 . . . . 4.1200000000000001 111.245 177.092 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.68 -15.46 71.09 Favored Glycine 0 CA--C 1.519 0.314 0 C-N-CA 120.943 -0.646 . . . . 0.80000000000000004 113.097 -178.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.562 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 20.3 tpp180 -69.82 -43.49 71.91 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.218 0.532 . . . . 4.9100000000000001 110.622 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.478 ' O ' ' HD1' ' A' ' 104' ' ' PHE . 61.2 mt -68.09 -34.98 69.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.447 -0.797 . . . . 1.1100000000000001 111.38 -175.036 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -60.74 -29.19 44.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 120.841 0.353 . . . . 2.0299999999999998 110.774 179.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.438 ' O ' ' HD1' ' A' ' 106' ' ' PHE . . . -62.55 -46.93 86.1 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.447 0.641 . . . . 1.0600000000000001 110.268 177.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.608 ' HA ' ' HE1' ' A' ' 106' ' ' PHE . 30.8 t80 -53.43 -37.71 62.82 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.356 -1.293 . . . . 1.8400000000000001 111.211 177.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.675 ' HZ ' HD11 ' A' ' 134' ' ' LEU . 47.7 m-85 -76.53 -39.47 52.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.298 -0.41 . . . . 4.21 111.116 178.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.687 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 22.6 t -63.04 -54.86 31.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.013 -0.54 . . . . 1.55 111.317 -176.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.608 ' HE1' ' HA ' ' A' ' 103' ' ' PHE . 3.9 p90 -76.81 -23.51 52.82 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.436 -0.506 . . . . 3.6400000000000001 110.41 -177.404 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.38 -44.64 73.12 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 110.8 -0.92 . . . . 0.32000000000000001 110.8 174.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.972 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.32 -31.18 79.64 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.874 -0.679 . . . . 0.23999999999999999 111.53 175.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -76.0 -28.87 57.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.787 0.327 . . . . 1.05 110.745 176.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.456 ' HB3' HD12 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.66 -41.78 98.17 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.083 -1.08 . . . . 1.78 108.083 178.366 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.625 ' SG ' HG21 ' A' ' 123' ' ' VAL . 16.9 t -49.63 -51.66 36.14 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 113.449 -1.705 . . . . 0.90000000000000002 110.964 172.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.552 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 69.1 t -65.66 -40.94 89.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.346 -0.388 . . . . 1.2 111.924 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.686 ' HB3' HG21 ' A' ' 74' ' ' ILE . 18.3 mm-40 -63.03 -22.85 67.14 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.238 0.542 . . . . 2.5099999999999998 110.499 178.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.475 ' HB3' ' HB2' ' A' ' 122' ' ' LEU . 26.4 m -76.99 -37.76 54.5 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.977 -0.749 . . . . 0.28000000000000003 108.977 174.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.578 HG23 ' O ' ' A' ' 111' ' ' CYS . 98.1 t -66.17 -35.11 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.147 -0.933 . . . . 1.8300000000000001 109.332 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.502 ' OD2' ' HD3' ' A' ' 117' ' ' LYS . 25.9 t70 -52.0 -51.22 58.76 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 113.48 -1.691 . . . . 0.59999999999999998 111.597 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.502 ' HD3' ' OD2' ' A' ' 116' ' ' ASP . 12.7 mmtp -85.38 13.78 6.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.017 -0.538 . . . . 2.1600000000000001 110.282 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.409 ' HA ' HE21 ' A' ' 120' ' ' GLN . 46.1 mt-10 61.79 44.38 8.68 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.715 0.769 . . . . 1.8799999999999999 110.53 -178.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.465 ' HB3' HD21 ' A' ' 122' ' ' LEU . 25.8 mtm -119.74 44.8 2.3 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 107.871 -1.159 . . . . 1.0800000000000001 107.871 -179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.443 ' HA ' HG23 ' A' ' 123' ' ' VAL . 3.1 mt-30 -60.4 -7.2 1.9 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.52 -1.218 . . . . 1.1499999999999999 112.845 -175.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.524 HG22 HD22 ' A' ' 122' ' ' LEU . 27.4 m -67.29 -25.14 32.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.628 0.251 . . . . 1.1899999999999999 111.205 172.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.524 HD22 HG22 ' A' ' 121' ' ' VAL . 3.5 mm? -70.93 -29.33 65.34 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 110.161 -0.311 . . . . 1.0600000000000001 110.161 177.449 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.625 HG21 ' SG ' ' A' ' 111' ' ' CYS . 72.2 t -44.79 -53.57 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 123.841 0.713 . . . . 1.0 111.78 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.61 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 0.0 OUTLIER -70.68 -37.15 73.6 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 116.057 -0.52 . . . . 1.6599999999999999 111.244 -179.565 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.503 ' HD3' HD11 ' A' ' 122' ' ' LEU . 60.8 mtp180 -62.36 -57.05 12.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 116.142 -0.481 . . . . 3.2999999999999998 110.502 -179.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.575 HG23 ' SD ' ' A' ' 130' ' ' MET . 76.7 mt -52.53 -49.82 42.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.677 -0.692 . . . . 1.0600000000000001 110.613 -178.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.6 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.96 -36.84 70.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.942 0.401 . . . . 1.1000000000000001 111.193 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.75 -60.86 2.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.336 0.589 . . . . 1.1200000000000001 110.397 176.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -60.17 -32.61 71.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.638 -1.165 . . . . 4.7699999999999996 111.227 -176.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.579 ' SD ' HD11 ' A' ' 13' ' ' LEU . 89.2 mtp -63.51 -56.43 16.11 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.954 0.407 . . . . 1.0900000000000001 110.765 177.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.44 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -61.17 -37.03 81.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.27 -0.423 . . . . 1.05 110.545 179.394 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.412 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 98.0 m -63.22 -45.12 93.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.454 -0.339 . . . . 1.1299999999999999 111.232 177.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -56.45 -40.34 74.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.176 0.512 . . . . 3.3500000000000001 109.877 177.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.964 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.2 tt -65.06 -49.67 69.17 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.313 -0.625 . . . . 1.5900000000000001 109.313 175.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . 0.412 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 4.7 m-80 -49.91 -49.12 50.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.792 -0.64 . . . . 0.46000000000000002 111.905 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -81.97 -54.54 5.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.15 -0.477 . . . . 0.58999999999999997 111.86 -176.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.76 -51.03 5.43 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.283 0.846 . . . . 2.3399999999999999 113.283 -169.012 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.964 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -79.88 -44.18 20.91 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 114.054 1.131 . . . . 1.8999999999999999 114.054 -165.006 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.647 ' HA ' HD13 ' A' ' 142' ' ' ILE . 37.0 tt0 -47.18 -51.73 39.65 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 112.69 0.626 . . . . 0.75 112.69 -174.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.556 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 51.1 Cg_exo -52.75 -50.66 13.29 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 121.962 1.774 . . . . 0.87 111.784 177.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 4.2 t-105 -58.44 -50.75 72.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.51 -0.768 . . . . 1.4299999999999999 110.441 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.647 HD13 ' HA ' ' A' ' 139' ' ' GLU . 54.7 mt -46.43 -53.87 2.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.117 -0.492 . . . . 1.1299999999999999 111.613 175.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.593 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 78.3 mm-40 -59.16 -34.15 71.76 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.689 -0.687 . . . . 0.57999999999999996 111.723 -178.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 67.8 mm-40 -63.3 -25.76 68.46 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.573 0.701 . . . . 0.78000000000000003 111.029 177.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.62 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -96.06 -16.67 21.46 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.182 -0.917 . . . . 0.93000000000000005 109.625 -171.855 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 142.62 -40.05 1.3 Allowed Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.478 -0.783 . . . . 0.56000000000000005 112.665 175.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . 0.449 ' H ' ' HH2' ' A' ' 97' ' ' TRP . . . 120.36 170.62 14.3 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.958 -0.639 . . . . 0.48999999999999999 111.675 -178.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.696 ' HZ2' HD23 ' A' ' 134' ' ' LEU . 6.8 m0 -65.92 -35.09 79.65 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.923 0.342 . . . . 4.5199999999999996 111.923 -175.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.539 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 8.8 m-20 -63.23 -31.08 72.14 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.697 0.284 . . . . 1.96 110.247 177.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.516 ' O ' HD13 ' A' ' 154' ' ' LEU . 72.3 m -70.11 -36.06 74.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.416 -0.356 . . . . 1.24 110.867 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.575 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 91.1 t80 -62.27 -33.45 74.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.787 -0.82 . . . . 3.7200000000000002 108.787 178.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.539 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 90.8 t -63.88 -52.83 51.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 114.438 -1.255 . . . . 1.8600000000000001 111.131 174.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 24.0 mm-40 -48.75 -46.99 41.97 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.125 -0.943 . . . . 1.6699999999999999 111.643 176.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.516 HD13 ' O ' ' A' ' 150' ' ' THR . 8.2 mp -78.17 -60.81 2.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.998 0.74 . . . . 1.96 112.998 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -119.85 27.48 8.67 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.187 -0.46 . . . . 4.3899999999999997 110.632 -167.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.615 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -57.62 165.44 6.44 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 115.619 -0.719 . . . . 1.1000000000000001 114.336 -179.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . 0.903 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 29.4 t-20 . . . . . 0 C--N 1.316 -0.888 0 CA-C-N 113.308 -1.446 . . . . 1.29 112.107 -177.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1005 ' ' GLY . . . . . 0.908 ' HA2' ' HA ' ' A' ' 86' ' ' VAL . . . . . . . . 0 N--CA 1.43 -1.702 0 N-CA-C 110.594 -1.002 . . . . 1.26 110.594 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1006 ' ' ARG . . . . . 0.456 ' HD3' ' HA ' ' B' 1006 ' ' ARG . 29.4 mmt180 -56.63 -40.31 75.18 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 111.989 0.366 . . . . 3.4500000000000002 111.989 176.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -66.98 -52.39 43.35 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 120.692 0.282 . . . . 1.54 111.456 -175.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.665 ' HB2' HG21 ' A' ' 86' ' ' VAL . 3.8 mm? -75.14 -37.41 61.39 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.842 0.353 . . . . 1.8999999999999999 110.872 -174.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 0.824 ' HB1' ' HB3' ' A' ' 89' ' ' GLU . . . -45.72 -47.54 15.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.743 0.782 . . . . 1.45 110.057 165.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -75.56 -60.4 2.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.726 -1.124 . . . . 1.51 112.121 -177.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -59.0 -33.25 70.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.945 -0.571 . . . . 2.0699999999999998 111.829 -176.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -67.2 -20.79 71.5 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.886 -0.673 . . . . 0.80000000000000004 113.417 -175.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 28.3 t70 -67.56 -20.16 65.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.868 0.334 . . . . 1.8999999999999999 111.213 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 10.6 m . . . . . 0 C--O 1.227 -0.106 0 CA-C-O 120.901 0.381 . . . . 1.4399999999999999 110.952 -175.906 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 121.643 0.735 . . . . 2.7599999999999998 110.008 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 m -69.77 -15.42 63.13 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.02 -0.991 . . . . 1.54 112.351 -176.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.554 ' HA ' HD23 ' A' ' 8' ' ' LEU . 1.1 p30 -61.19 -18.7 59.57 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.092 -0.504 . . . . 1.78 110.848 175.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.599 ' O ' HG22 ' A' ' 10' ' ' VAL . 20.0 tpp85 -60.25 -45.5 93.04 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.861 -0.609 . . . . 1.8999999999999999 109.844 175.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.517 ' HB3' ' HZ3' ' A' ' 47' ' ' LYS . 42.6 mt-10 -59.56 -52.86 63.72 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.827 -0.624 . . . . 0.68000000000000005 111.274 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.554 HD23 ' HA ' ' A' ' 5' ' ' ASN . 2.7 mp -45.66 -37.46 5.76 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.223 -0.899 . . . . 1.8 111.47 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 70.0 t -76.81 -62.52 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.055 -0.521 . . . . 1.0700000000000001 110.659 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.599 HG22 ' O ' ' A' ' 6' ' ' ARG . 86.5 t -52.14 -49.96 37.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.373 -0.831 . . . . 1.1299999999999999 112.841 -174.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -54.07 -32.64 55.28 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.508 0.505 . . . . 0.58999999999999997 110.653 -175.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.539 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 55.7 t80 -84.12 -44.64 13.82 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.285 -0.416 . . . . 2.02 111.548 -179.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.875 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.7 mp -58.13 -40.5 81.42 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 120.024 -0.67 . . . . 1.0600000000000001 109.98 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.1 t -60.73 -40.89 94.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.99 -0.55 . . . . 1.6000000000000001 110.312 176.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -73.51 -25.39 60.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.814 -0.63 . . . . 1.49 111.309 -178.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.703 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.6 OUTLIER -78.52 -50.24 11.95 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-O 121.226 0.536 . . . . 1.8400000000000001 110.094 -174.637 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.691 HD22 ' SG ' ' A' ' 111' ' ' CYS . 13.2 mt -55.18 -29.78 58.56 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.511 -0.768 . . . . 1.98 111.277 173.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.7 t -60.81 -29.02 69.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.47 -0.787 . . . . 1.3799999999999999 111.908 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.703 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 20.8 pt20 -75.29 -16.72 60.41 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.201 0.524 . . . . 1.51 110.932 -176.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.763 ' HD2' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -100.66 -23.69 14.59 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 122.197 0.999 . . . . 2.6499999999999999 108.58 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.01 26.28 7.55 Favored Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 113.651 -1.613 . . . . 0.54000000000000004 112.468 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.466 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 86.8 m-85 -112.61 166.61 11.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.542 0.21 . . . . 1.1200000000000001 110.801 176.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.1 t -109.31 151.29 26.79 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.263 -0.426 . . . . 0.75 110.632 -178.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.664 ' CH2' ' HB2' ' A' ' 31' ' ' GLU . 3.0 t90 -75.06 -52.9 9.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.073 -0.512 . . . . 4.29 110.356 175.257 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.425 ' HB2' ' CE3' ' A' ' 24' ' ' TRP . 22.6 t -72.45 -18.55 61.68 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.227 -0.442 . . . . 1.8600000000000001 111.495 -172.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -65.53 -22.48 66.72 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.191 -0.604 . . . . 1.52 110.785 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -108.96 -33.75 6.83 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.826 -0.625 . . . . 1.53 110.863 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.6 m -101.54 143.84 31.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.71 0.767 . . . . 2.04 112.112 -177.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.464 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 15.4 t70 -108.15 -7.4 16.05 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.162 -1.381 . . . . 2.3100000000000001 109.383 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.624 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.0 m -53.61 -72.97 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 114.067 -1.424 . . . . 1.4099999999999999 112.915 -170.116 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.664 ' HB2' ' CH2' ' A' ' 24' ' ' TRP . 20.5 mm-40 -91.57 1.5 57.1 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.965 -0.754 . . . . 2.7400000000000002 108.965 178.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.464 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.1 tt0 . . . . . 0 N--CA 1.446 -0.639 0 CA-C-N 114.834 -1.075 . . . . 1.45 110.205 179.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.676 HG21 ' H ' ' A' ' 42' ' ' GLU . 1.3 t . . . . . 0 CA--C 1.541 0.617 0 N-CA-C 110.145 -0.317 . . . . 1.45 110.145 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.676 ' H ' HG21 ' A' ' 41' ' ' THR . 0.0 OUTLIER -92.18 -34.98 14.09 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.551 0.691 . . . . 2.02 109.393 169.095 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.752 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 7.3 p -47.95 -39.29 18.89 Favored 'General case' 0 C--O 1.214 -0.794 0 CA-C-N 113.943 -1.481 . . . . 1.25 112.846 -171.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -39.4 -51.17 2.11 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 123.946 0.779 . . . . 1.9099999999999999 111.989 -175.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.72 -42.61 50.29 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 121.186 -0.206 . . . . 1.1799999999999999 111.414 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.718 HG11 ' HA ' ' A' ' 43' ' ' SER . 0.5 OUTLIER -68.0 -44.87 84.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 N-CA-C 111.652 0.241 . . . . 2.0099999999999998 111.652 -175.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.752 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.0 ptpt -67.35 -39.3 85.73 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.293 -0.632 . . . . 1.3799999999999999 109.293 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.46 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 5.6 mm100 -57.83 -43.83 86.07 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 115.631 -0.713 . . . . 0.98999999999999999 111.635 174.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.564 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -70.46 -34.95 73.0 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.243 0.544 . . . . 1.1399999999999999 110.42 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.433 ' HG ' ' CE1' ' A' ' 104' ' ' PHE . 4.0 tp -64.84 -28.48 69.58 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.322 -0.854 . . . . 1.95 111.695 -175.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.414 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 3.8 ptp85 -86.88 -23.04 25.37 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.271 0.558 . . . . 2.5099999999999998 110.108 -177.296 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.59 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.3 mm-40 -70.63 -47.42 60.14 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.091 -0.959 . . . . 1.1000000000000001 109.826 175.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.03 -36.47 75.09 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.736 -0.665 . . . . 1.04 109.438 171.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.632 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -57.9 -44.54 94.37 Favored Glycine 0 C--O 1.219 -0.79 0 CA-C-N 114.995 -1.002 . . . . 0.69999999999999996 112.276 178.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -52.36 -44.59 65.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.906 0.384 . . . . 1.04 111.329 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 41.6 mt-10 -67.47 -29.05 68.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.791 -0.641 . . . . 2.29 111.721 179.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.482 ' HE1' ' HA2' ' B' 1012 ' ' GLY . 13.4 m-85 -81.03 -41.96 21.85 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.973 -0.558 . . . . 2.9300000000000002 111.255 176.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.632 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.0 mt-10 -55.85 -50.02 71.73 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.189 0.519 . . . . 1.3 109.869 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.449 HD13 ' N ' ' A' ' 60' ' ' ARG . 3.8 pp -64.6 -35.05 79.73 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.232 -0.894 . . . . 2.1899999999999999 110.648 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.453 ' HB2' ' O ' ' A' ' 56' ' ' GLU . 8.6 ttt180 -70.1 -44.96 67.96 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 120.377 -0.529 . . . . 3.1400000000000001 111.203 -167.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -90.54 -3.75 57.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.294 -0.412 . . . . 5.5899999999999999 111.196 -179.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.497 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 51.2 ttp180 -50.06 -37.23 32.46 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.174 0.805 . . . . 4.9299999999999997 113.174 -171.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 -66.97 -38.79 86.74 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.985 0.422 . . . . 5.3499999999999996 110.937 -179.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.649 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.76 -42.82 9.36 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.603 0.964 . . . . 1.7 113.603 -172.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.497 ' CD1' ' HA ' ' A' ' 62' ' ' ARG . 8.1 p90 -52.69 -39.13 61.68 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.045 1.128 . . . . 3.52 114.045 -161.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.9 t -85.49 -21.74 28.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.155 0.502 . . . . 2.5899999999999999 110.066 -175.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -77.46 -31.84 54.07 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.038 -0.727 . . . . 2.7200000000000002 109.038 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 61.8 mt -63.46 -15.09 56.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.975 -1.011 . . . . 2.25 112.032 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.798 HG23 HG13 ' A' ' 74' ' ' ILE . 17.5 p -54.36 -37.06 64.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.254 0.55 . . . . 1.26 110.474 -177.158 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 67.2 m -61.71 -31.51 71.66 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.063 -0.971 . . . . 1.8 111.123 176.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.593 ' NE2' HD22 ' A' ' 68' ' ' LEU . 10.2 mt-30 -80.69 -47.69 13.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.603 -0.726 . . . . 1.8899999999999999 110.224 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.598 HD11 ' O ' ' A' ' 68' ' ' LEU . 1.1 mp -68.1 -31.81 71.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.544 -0.753 . . . . 1.98 110.444 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.439 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 50.4 m-70 68.51 64.06 0.34 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.607 0.718 . . . . 3.54 109.91 -173.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.798 HG13 HG23 ' A' ' 69' ' ' THR . 26.0 mm -65.02 108.88 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.477 -1.238 . . . . 1.1499999999999999 110.594 178.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.736 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.83 -171.49 0.27 Allowed Pre-proline 0 C--N 1.316 -0.869 0 N-CA-C 107.45 -1.315 . . . . 1.1200000000000001 107.45 -169.396 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.736 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.0 Cg_exo -30.91 166.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 124.777 3.652 . . . . 0.53000000000000003 114.766 164.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.473 ' N ' HD13 ' A' ' 122' ' ' LEU . . . -29.33 -28.87 0.01 OUTLIER Glycine 0 N--CA 1.476 1.353 0 N-CA-C 117.225 1.65 . . . . 0.40999999999999998 117.225 -173.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.46 ' N ' ' O ' ' A' ' 76' ' ' PRO . 31.2 p -68.87 3.46 1.96 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.838 0.819 . . . . 1.22 112.0 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.02 -14.51 61.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.184 0.516 . . . . 1.0700000000000001 109.675 170.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.434 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 44.0 t80 -75.54 -22.79 56.75 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.761 -0.654 . . . . 4.3099999999999996 109.372 174.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.426 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 34.0 mt-30 -82.57 -23.9 34.23 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.625 0.726 . . . . 1.03 109.865 174.093 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 13.7 m -72.68 -53.76 10.86 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 114.557 -1.201 . . . . 0.47999999999999998 109.565 171.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.542 ' HA ' HG22 ' A' ' 86' ' ' VAL . 85.3 t80 -65.79 -17.92 64.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.029 -0.987 . . . . 1.4399999999999999 110.229 175.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.59 ' HA ' HG12 ' A' ' 87' ' ' VAL . 34.7 tt0 -60.9 -49.34 77.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.884 -0.598 . . . . 0.80000000000000004 110.389 177.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -50.6 -34.31 25.42 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.988 -1.006 . . . . 1.99 110.622 176.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.589 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 1.8 t -80.63 -51.54 15.64 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 114.646 -1.161 . . . . 1.8999999999999999 110.602 -176.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.59 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.0 p -63.54 -21.75 29.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.826 0.822 . . . . 1.4299999999999999 109.841 -179.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.469 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.2 m-80 -78.53 -45.49 21.76 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.367 -1.288 . . . . 0.91000000000000003 111.615 175.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 1.033 ' HB2' ' HB3' ' B' 1009 ' ' ALA . 16.2 pt-20 -69.57 -32.3 70.98 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 107.961 -1.125 . . . . 2.8700000000000001 107.961 -178.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' A' ' 86' ' ' VAL . 0.2 OUTLIER -60.61 -31.06 70.25 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 113.182 -1.827 . . . . 1.9199999999999999 111.152 177.983 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.678 ' HA ' HG23 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -99.27 -38.29 8.93 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.07 0.462 . . . . 2.9700000000000002 111.29 -169.533 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.532 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 10.3 ptm180 -72.65 -34.22 67.11 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.652 -0.704 . . . . 5.6699999999999999 110.586 -174.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -89.13 8.63 29.02 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.851 -1.068 . . . . 3.1200000000000001 112.31 -172.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.68 72.52 0.11 Allowed Glycine 0 C--N 1.337 0.618 0 C-N-CA 117.01 -2.519 . . . . 2.3100000000000001 116.15 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.799 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 48.8 t -71.1 92.62 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 CA-C-N 119.053 1.427 . . . . 1.6799999999999999 111.361 177.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.434 ' ND2' ' N ' ' A' ' 96' ' ' ASN . 1.1 m120 -114.65 -170.81 1.81 Allowed 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.493 -1.23 . . . . 2.1200000000000001 108.854 178.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.831 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 13.4 m-90 -58.84 -38.0 77.72 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.064 0.459 . . . . 4.1200000000000001 110.865 177.484 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.55 ' O ' ' HB ' ' A' ' 101' ' ' VAL . . . -83.47 -32.19 25.66 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.91 -0.662 . . . . 0.80000000000000004 114.536 -170.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.799 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 0.6 OUTLIER -69.1 -30.08 68.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 118.078 0.939 . . . . 4.9100000000000001 109.587 -176.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 82.2 mt -69.81 -34.19 59.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.4 0.619 . . . . 1.1100000000000001 109.53 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.55 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 79.5 t -55.03 -58.66 3.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 114.935 -1.029 . . . . 2.0299999999999998 110.045 168.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -51.39 -41.74 60.92 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.773 -0.649 . . . . 1.0600000000000001 110.873 176.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -59.78 -54.3 47.9 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.441 -0.799 . . . . 1.8400000000000001 112.02 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.494 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.4 OUTLIER -72.76 -23.53 60.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.035 0.445 . . . . 4.21 110.435 -176.44 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.539 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 13.3 t -76.32 -53.88 7.57 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.794 -0.639 . . . . 1.55 110.521 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -66.9 -28.07 68.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.009 0.433 . . . . 3.6400000000000001 109.911 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.485 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -65.72 -44.09 93.0 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.79 -0.641 . . . . 0.32000000000000001 111.71 174.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.875 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.79 -35.27 91.8 Favored Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.461 -0.876 . . . . 0.23999999999999999 111.222 175.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.73 -28.91 65.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.556 -0.322 . . . . 1.05 110.81 177.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.409 ' HB3' HD12 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.24 -39.62 95.12 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.171 -1.048 . . . . 1.78 108.171 179.407 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.739 ' HG ' HG11 ' A' ' 123' ' ' VAL . 42.1 t -55.24 -53.04 61.12 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 113.989 -1.46 . . . . 0.90000000000000002 110.735 174.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.763 HG13 ' HD2' ' A' ' 20' ' ' LYS . 65.9 t -63.14 -39.6 85.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.403 -0.362 . . . . 1.2 111.852 -177.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.438 ' HB3' HG23 ' A' ' 74' ' ' ILE . 2.5 mm-40 -65.57 -22.89 66.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.058 0.456 . . . . 2.5099999999999998 110.917 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 49.1 m -79.28 -41.34 28.32 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.903 -0.777 . . . . 0.28000000000000003 108.903 175.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.591 HG22 ' CD2' ' A' ' 17' ' ' LEU . 98.0 t -65.42 -32.94 60.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 114.999 -1.0 . . . . 1.8300000000000001 109.293 179.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.36 -50.55 59.3 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 113.313 -1.767 . . . . 0.59999999999999998 111.411 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.422 ' CG ' ' HE2' ' A' ' 119' ' ' MET . 10.9 mmtp -87.03 11.07 14.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.829 -0.623 . . . . 2.1600000000000001 110.441 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.477 ' HA ' HE21 ' A' ' 120' ' ' GLN . 39.7 mt-10 66.03 43.56 2.92 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-O 121.662 0.744 . . . . 1.8799999999999999 110.227 -178.075 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.437 ' HE1' ' HB2' ' A' ' 119' ' ' MET . 26.6 mtm -118.22 48.42 1.42 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.073 -1.084 . . . . 1.0800000000000001 108.073 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.477 HE21 ' HA ' ' A' ' 118' ' ' GLU . 2.4 mt-30 -63.73 -7.27 7.18 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.641 -1.163 . . . . 1.1499999999999999 112.529 -175.092 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.506 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 34.2 m -65.19 -27.2 41.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 120.708 0.29 . . . . 1.1899999999999999 110.918 174.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.705 HD11 ' HD2' ' A' ' 125' ' ' ARG . 2.9 mm? -72.48 -27.33 62.22 Favored 'General case' 0 CA--C 1.51 -0.562 0 CA-C-N 116.589 -0.278 . . . . 1.0600000000000001 110.684 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.739 HG11 ' HG ' ' A' ' 111' ' ' CYS . 70.3 t -44.22 -53.44 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 O-C-N 123.8 0.687 . . . . 1.0 111.938 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.2 -35.69 66.4 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.756 -0.656 . . . . 1.6599999999999999 111.393 -178.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.705 ' HD2' HD11 ' A' ' 122' ' ' LEU . 70.8 mtt180 -64.78 -52.53 56.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.827 -0.624 . . . . 3.2999999999999998 110.344 -178.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.583 HG21 ' SD ' ' A' ' 130' ' ' MET . 73.1 mt -54.11 -51.89 42.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.605 -0.725 . . . . 1.0600000000000001 110.785 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.675 ' HB1' HD21 ' A' ' 13' ' ' LEU . . . -57.46 -36.34 71.3 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.713 0.292 . . . . 1.1000000000000001 111.417 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.27 -58.8 6.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.288 0.566 . . . . 1.1200000000000001 110.67 177.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.403 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 99.2 m95 -64.24 -33.71 76.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.021 -0.99 . . . . 4.7699999999999996 111.49 -176.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.583 ' SD ' HG21 ' A' ' 126' ' ' ILE . 88.8 mtp -61.96 -54.59 39.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.04 0.448 . . . . 1.0900000000000001 110.75 178.333 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.89 94.8 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.798 -0.637 . . . . 1.05 111.086 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 92.0 m -62.75 -43.9 97.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.875 0.369 . . . . 1.1299999999999999 110.776 178.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.577 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 71.8 t80 -56.34 -42.85 78.39 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.226 -0.443 . . . . 3.3500000000000001 110.032 176.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.912 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 4.9 tt -63.36 -48.01 79.72 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.102 -0.703 . . . . 1.5900000000000001 109.102 175.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -49.83 -55.67 13.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.895 -0.593 . . . . 0.46000000000000002 112.59 178.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -83.49 -47.2 11.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.064 0.459 . . . . 0.58999999999999997 111.82 -173.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . 0.577 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 44.3 m-70 -90.92 -51.36 5.39 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 112.756 0.65 . . . . 2.3399999999999999 112.756 -170.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.912 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -83.23 -46.59 12.49 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 114.515 1.302 . . . . 1.8999999999999999 114.515 -165.072 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.641 ' HA ' HD11 ' A' ' 142' ' ' ILE . 28.3 tt0 -44.98 -52.42 19.4 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.432 0.53 . . . . 0.75 112.432 -173.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.6 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.3 Cg_exo -53.38 -53.52 6.49 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.654 1.57 . . . . 0.87 111.715 176.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -55.0 -51.11 67.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.583 -0.735 . . . . 1.4299999999999999 110.347 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.641 HD11 ' HA ' ' A' ' 139' ' ' GLU . 73.6 mt -46.83 -53.89 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.823 -0.626 . . . . 1.1299999999999999 111.805 174.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.59 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 77.3 mm-40 -61.95 -29.87 70.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.896 -0.593 . . . . 0.57999999999999996 111.725 -178.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.6 mm-40 -64.81 -20.77 66.57 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.78 0.8 . . . . 0.78000000000000003 109.898 175.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.646 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -104.23 2.26 31.46 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.89 -1.05 . . . . 0.93000000000000005 108.783 -176.652 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 127.1 -54.39 0.77 Allowed Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 114.668 -1.151 . . . . 0.56000000000000005 112.011 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . 0.443 ' HA2' HG23 ' A' ' 142' ' ' ILE . . . 137.41 -177.75 19.59 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.922 -0.656 . . . . 0.48999999999999999 111.784 -177.439 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 11.8 m0 -68.02 -45.63 73.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.179 0.514 . . . . 4.5199999999999996 110.084 -179.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -63.72 -34.57 78.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.458 -0.792 . . . . 1.96 111.123 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.581 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 66.0 m -66.77 -30.66 70.92 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.493 -0.322 . . . . 1.24 111.702 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.831 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 86.8 t80 -59.14 -38.54 79.95 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.339 -0.544 . . . . 3.7200000000000002 109.84 174.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.539 HG12 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -75.83 -25.73 17.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.261 -0.427 . . . . 1.8600000000000001 110.19 177.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.565 ' CG ' ' HA ' ' A' ' 150' ' ' THR . 55.1 mt-10 -55.52 -31.0 61.71 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-O 121.216 0.531 . . . . 1.6699999999999999 109.835 172.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' A' ' 150' ' ' THR . 0.6 OUTLIER -101.92 -50.67 3.61 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.397 -0.819 . . . . 1.96 110.984 -176.664 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . 0.446 ' CD2' ' HB2' ' A' ' 154' ' ' LEU . 97.9 m-85 -120.69 26.08 9.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.789 -0.641 . . . . 4.3899999999999997 111.653 -170.073 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.564 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -60.22 164.12 15.21 Favored Glycine 0 C--N 1.317 -0.506 0 CA-C-O 121.733 0.629 . . . . 1.1000000000000001 113.685 -176.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . 0.59 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 29.3 t-20 . . . . . 0 C--N 1.312 -1.048 0 CA-C-N 113.835 -1.182 . . . . 1.29 112.212 -176.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1005 ' ' GLY . . . . . 0.855 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.539 1.577 0 N-CA-C 111.902 -0.479 . . . . 1.26 111.902 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -133.14 -61.27 0.83 Allowed 'General case' 0 C--O 1.227 -0.111 0 C-N-CA 124.325 1.05 . . . . 3.4500000000000002 110.387 -177.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -70.32 -49.44 49.4 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.14 -0.936 . . . . 1.54 112.593 -169.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.575 ' HB2' ' CD ' ' A' ' 89' ' ' GLU . 2.8 mm? -66.53 -39.82 88.8 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.084 -0.71 . . . . 1.8999999999999999 109.084 -176.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 1.033 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . . . -52.19 -57.46 9.59 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.51 -1.223 . . . . 1.45 110.44 171.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -69.22 -38.05 78.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 113.905 -1.498 . . . . 1.51 112.276 -172.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 3.9 m-30 -74.77 -24.57 58.71 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.236 -0.438 . . . . 2.0699999999999998 111.084 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1012 ' ' GLY . . . . . 0.482 ' HA2' ' HE1' ' A' ' 57' ' ' PHE . . . -76.95 -9.84 86.5 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 121.151 -0.547 . . . . 0.80000000000000004 112.937 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.08 -23.66 66.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.962 0.411 . . . . 1.8999999999999999 111.241 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 69.8 m . . . . . 0 C--N 1.328 -0.349 0 CA-C-O 120.838 0.351 . . . . 1.4399999999999999 110.961 -175.146 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 . . . . . 0 N--CA 1.451 -0.388 0 CA-C-O 120.786 0.326 . . . . 2.7599999999999998 111.77 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.501 ' HB3' ' OE2' ' A' ' 42' ' ' GLU . 4.8 m -67.6 -30.41 69.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.399 -0.364 . . . . 1.54 110.732 176.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.476 ' ND2' HD21 ' A' ' 134' ' ' LEU . 0.0 OUTLIER -62.3 -15.31 47.05 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.158 0.504 . . . . 1.78 110.109 -178.436 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.678 HH12 ' HA ' ' A' ' 128' ' ' ALA . 24.6 tpp180 -52.99 -49.94 65.16 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.368 -0.833 . . . . 1.8999999999999999 110.743 174.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.607 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 42.8 mt-10 -52.6 -52.01 57.22 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.366 -1.288 . . . . 0.68000000000000005 111.873 -174.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.512 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -46.42 -45.96 18.34 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.163 -0.926 . . . . 1.8 110.788 177.656 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.629 HG13 ' HE3' ' A' ' 130' ' ' MET . 70.9 t -68.59 -61.36 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-O 121.253 0.549 . . . . 1.0700000000000001 110.187 178.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 6' ' ' ARG . 63.3 t -51.65 -52.47 21.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 114.917 -1.038 . . . . 1.1299999999999999 112.66 -173.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -58.98 -35.31 72.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.065 -0.516 . . . . 0.58999999999999997 111.105 -176.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.683 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 26.9 t80 -77.35 -38.67 49.79 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 120.561 -0.456 . . . . 2.02 111.178 -176.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.796 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.3 mp -59.4 -38.78 81.46 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 119.825 -0.75 . . . . 1.0600000000000001 109.499 175.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.423 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 40.6 t -60.8 -45.67 93.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.369 0.604 . . . . 1.6000000000000001 110.581 175.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -62.08 -32.56 73.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.275 -0.875 . . . . 1.49 111.037 -178.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.638 ' HA ' ' CE ' ' A' ' 16' ' ' LYS . 4.4 mmpt? -72.46 -43.94 63.02 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 113.102 0.778 . . . . 1.8400000000000001 113.102 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.651 HD23 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -64.39 -24.17 67.54 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.76 -0.376 . . . . 1.98 111.159 -178.376 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.0 t -58.09 -45.12 87.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.47 . . . . 1.3799999999999999 111.554 -178.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -76.87 0.26 21.51 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.05 0.452 . . . . 1.51 111.834 -177.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.0 mmmt -109.98 -28.19 8.85 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.816 0.817 . . . . 2.6499999999999999 109.313 -178.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.82 23.26 9.43 Favored Glycine 0 N--CA 1.442 -0.905 0 CA-C-N 114.087 -1.415 . . . . 0.54000000000000004 111.303 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -116.16 166.78 11.64 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.234 -0.483 . . . . 1.1200000000000001 110.395 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.433 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 5.6 t -110.27 147.61 33.52 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.11 -0.496 . . . . 0.75 110.048 179.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.423 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -77.35 -47.3 20.28 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.088 -0.505 . . . . 4.29 110.192 177.177 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.5 m -62.16 -36.13 80.92 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.773 0.286 . . . . 1.8600000000000001 111.773 -178.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.433 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 96.6 mt-30 -55.0 -28.0 48.53 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.864 0.364 . . . . 1.52 111.908 -178.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.46 ' O ' ' HB2' ' A' ' 124' ' ' SER . 35.9 m-85 -116.6 -14.93 10.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.353 -0.385 . . . . 1.53 111.512 -175.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.575 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 50.8 m -101.37 153.56 19.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.727 0.775 . . . . 2.04 112.581 -176.179 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.4 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.2 t70 -125.8 -10.92 6.68 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.116 -1.402 . . . . 2.3100000000000001 109.766 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.658 HG22 ' H ' ' A' ' 31' ' ' GLU . 4.2 m -46.97 -71.26 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.926 -1.488 . . . . 1.4099999999999999 113.1 -166.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.658 ' H ' HG22 ' A' ' 30' ' ' VAL . 8.1 pt-20 -99.32 1.82 44.85 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.203 -0.666 . . . . 2.7400000000000002 109.203 177.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.4 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.7 tt0 . . . . . 0 N--CA 1.448 -0.542 0 CA-C-N 115.078 -0.964 . . . . 1.45 111.457 -175.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.612 HG21 ' H ' ' A' ' 42' ' ' GLU . 0.3 OUTLIER . . . . . 0 CA--C 1.535 0.394 0 N-CA-C 110.035 -0.357 . . . . 1.45 110.035 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.612 ' H ' HG21 ' A' ' 41' ' ' THR . 0.0 OUTLIER -91.62 -36.74 13.48 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 122.017 0.913 . . . . 2.02 109.515 171.209 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.782 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 75.0 m -69.07 -23.92 64.09 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 113.772 -1.558 . . . . 1.25 114.595 -165.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -56.95 -44.31 82.41 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 119.889 -0.724 . . . . 1.9099999999999999 110.159 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.511 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -75.64 -39.71 57.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.017 0.436 . . . . 1.1799999999999999 110.335 175.26 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.782 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 60.1 t -54.94 -60.38 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.508 -0.769 . . . . 2.0099999999999998 111.671 178.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.607 ' NZ ' ' HB3' ' A' ' 7' ' ' GLU . 15.1 ptpt -60.07 -34.94 74.12 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.273 -0.64 . . . . 1.3799999999999999 109.273 -178.28 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.566 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 4.7 mm100 -66.6 -32.47 73.83 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.763 -0.653 . . . . 0.98999999999999999 111.054 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.668 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -81.48 -35.67 30.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.351 0.596 . . . . 1.1399999999999999 110.315 176.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.711 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.5 mp -66.56 -22.92 66.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.49 -0.777 . . . . 1.95 111.996 -177.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.566 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.3 ptp180 -86.18 -27.94 24.23 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.106 -0.702 . . . . 2.5099999999999998 109.106 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.718 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.1 mm-40 -70.12 -47.93 59.66 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.653 -1.158 . . . . 1.1000000000000001 109.524 174.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.411 ' HB1' ' HD2' ' A' ' 155' ' ' TYR . . . -68.02 -38.88 83.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.447 -0.797 . . . . 1.04 110.268 174.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.671 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -61.84 -42.78 99.78 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.51 -0.768 . . . . 0.69999999999999996 112.489 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -54.08 -44.6 71.29 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.883 0.373 . . . . 1.04 111.04 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.402 ' HA ' ' CD2' ' A' ' 59' ' ' LEU . 37.3 mt-10 -63.38 -29.22 70.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.934 -0.575 . . . . 2.29 111.388 178.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.497 ' HZ ' HD11 ' B' 1008 ' ' LEU . 71.3 t80 -77.5 -39.87 44.82 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.207 -0.451 . . . . 2.9300000000000002 110.294 177.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.671 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.4 mt-10 -62.81 -46.89 85.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.868 -0.605 . . . . 1.3 111.067 -176.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.507 HD13 ' N ' ' A' ' 60' ' ' ARG . 4.5 pp -59.25 -33.08 70.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.215 -0.448 . . . . 2.1899999999999999 112.028 -175.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.507 ' N ' HD13 ' A' ' 59' ' ' LEU . 5.7 ptp85 -87.34 -35.38 18.42 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.332 -0.547 . . . . 3.1400000000000001 112.353 -174.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.535 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 0.9 OUTLIER -91.63 -5.71 53.42 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 120.732 -0.387 . . . . 5.5899999999999999 111.299 -178.436 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 58' ' ' GLU . 69.2 ttt180 -55.86 -32.5 63.7 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.285 -0.416 . . . . 4.9299999999999997 111.644 -174.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -54.34 -39.35 67.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.837 -0.62 . . . . 5.3499999999999996 111.96 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.402 ' O ' HD11 ' A' ' 68' ' ' LEU . . . -90.72 -28.83 18.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.549 -0.296 . . . . 1.7 111.736 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.663 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 28.0 t80 -51.82 -38.55 56.24 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.86 0.689 . . . . 3.52 112.86 -172.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.1 p -72.03 -34.83 69.11 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.859 0.318 . . . . 2.5899999999999999 111.859 -176.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -90.43 -32.21 16.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.914 0.388 . . . . 2.7200000000000002 111.226 -175.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.444 ' HA ' ' HG3' ' A' ' 71' ' ' GLN . 3.6 mp -60.51 -17.35 44.98 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 112.864 0.69 . . . . 2.25 112.864 -175.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.534 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 3.0 p -58.9 -35.73 73.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 118.794 0.725 . . . . 1.26 110.403 -178.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.1 m -65.93 -28.59 69.04 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.192 -0.913 . . . . 1.8 110.437 175.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.444 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 7.6 mt-30 -86.9 -36.16 18.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.341 -0.845 . . . . 1.8899999999999999 110.249 -177.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.534 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.4 mm? -65.39 -32.53 74.2 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 109.077 -0.712 . . . . 1.98 109.077 169.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.466 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 32.7 m80 66.11 39.01 4.49 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.292 -1.003 . . . . 3.54 108.292 -173.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.534 HG12 ' HB2' ' A' ' 72' ' ' LEU . 29.0 mm -45.18 117.34 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 113.634 -1.621 . . . . 1.1499999999999999 112.316 -177.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.763 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.7 -171.34 0.27 Allowed Pre-proline 0 N--CA 1.442 -0.872 0 CA-C-N 114.574 -1.194 . . . . 1.1200000000000001 108.019 -171.078 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.763 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 52.7 Cg_exo -28.62 166.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.364 1.35 0 C-N-CA 125.299 3.999 . . . . 0.53000000000000003 115.628 165.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.46 -30.34 0.01 OUTLIER Glycine 0 N--CA 1.47 0.962 0 N-CA-C 117.449 1.74 . . . . 0.40999999999999998 117.449 -172.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.447 ' HA ' ' CD1' ' A' ' 80' ' ' TYR . 28.2 p -67.07 6.4 0.54 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.942 0.871 . . . . 1.22 112.576 -178.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.01 -10.4 57.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.327 0.584 . . . . 1.0700000000000001 110.138 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.447 ' CD1' ' HA ' ' A' ' 78' ' ' THR . 4.9 p90 -73.97 -19.1 60.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.761 -0.654 . . . . 4.3099999999999996 109.835 175.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.576 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 25.9 mt-30 -87.48 -18.27 30.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.763 0.792 . . . . 1.03 110.288 174.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.1 m -75.88 -53.42 8.46 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.663 -1.153 . . . . 0.47999999999999998 108.844 170.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.445 ' CD2' ' HZ3' ' A' ' 129' ' ' TRP . 90.2 t80 -65.66 -15.39 62.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.85 -1.068 . . . . 1.4399999999999999 110.06 174.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.629 ' HA ' HG13 ' A' ' 87' ' ' VAL . 28.7 tt0 -60.78 -49.08 78.91 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 121.773 0.797 . . . . 0.80000000000000004 110.111 176.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.404 ' H ' ' HG2' ' A' ' 85' ' ' GLN . 62.8 mm-40 -50.16 -37.58 35.37 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.731 -1.577 . . . . 1.99 112.0 -176.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.567 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 3.6 p -91.62 -42.45 13.67 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 114.633 -1.167 . . . . 1.8999999999999999 111.799 -176.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.629 HG13 ' HA ' ' A' ' 84' ' ' GLU . 9.9 p -59.71 -24.07 28.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 122.077 0.941 . . . . 1.4299999999999999 109.399 176.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.3 m-80 -71.51 -39.78 70.58 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.037 -1.438 . . . . 0.91000000000000003 111.691 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.736 ' HA ' ' HD2' ' A' ' 92' ' ' ARG . 1.6 pp20? -77.9 -32.44 51.76 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.53 0.681 . . . . 2.8700000000000001 109.653 -179.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.608 HD11 HH11 ' A' ' 99' ' ' ARG . 0.2 OUTLIER -61.71 -30.97 71.11 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.214 -1.357 . . . . 1.9199999999999999 112.008 -165.912 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -107.41 -30.06 8.89 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.208 0.447 . . . . 2.9700000000000002 112.208 -175.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.736 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -65.27 -22.05 66.8 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.066 0.46 . . . . 5.6699999999999999 111.901 -169.306 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.507 ' N ' ' HD3' ' A' ' 92' ' ' ARG . 28.1 t70 -92.91 -13.86 28.36 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.795 -0.638 . . . . 3.1200000000000001 111.67 -172.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.16 69.78 0.11 Allowed Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 118.862 -1.637 . . . . 2.3100000000000001 112.805 -173.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.551 HG11 ' CD1' ' A' ' 141' ' ' TRP . 0.1 OUTLIER -67.77 109.81 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 122.992 1.377 . . . . 1.6799999999999999 110.499 -173.576 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -108.04 -170.89 1.76 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 113.391 -1.731 . . . . 2.1200000000000001 109.653 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.954 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 15.8 m-90 -54.9 -42.64 72.41 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.571 -0.74 . . . . 4.1200000000000001 110.664 177.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -77.27 -30.32 54.71 Favored Glycine 0 N--CA 1.452 -0.282 0 CA-C-N 115.909 -0.587 . . . . 0.80000000000000004 113.567 -174.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.735 HH12 ' HA ' ' B' 1009 ' ' ALA . 16.5 mmt180 -59.97 -36.61 77.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.314 0.578 . . . . 4.9100000000000001 111.368 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.474 HG12 ' HG ' ' A' ' 138' ' ' LEU . 94.5 mt -78.0 -32.35 17.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.601 -0.727 . . . . 1.1100000000000001 111.895 -173.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.6 m -65.16 -22.97 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.401 0.619 . . . . 2.0299999999999998 110.197 174.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.75 -42.85 19.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.205 0.526 . . . . 1.0600000000000001 110.049 175.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.411 ' HA ' ' CD2' ' A' ' 90' ' ' LEU . 22.5 t80 -54.71 -55.11 33.34 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.891 -1.05 . . . . 1.8400000000000001 111.358 177.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.81 ' HA ' ' HE2' ' A' ' 130' ' ' MET . 0.2 OUTLIER -70.87 -20.56 62.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.014 0.435 . . . . 4.21 110.292 -176.501 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.683 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 33.7 t -73.02 -50.61 22.1 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.927 -0.579 . . . . 1.55 110.362 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -70.28 -26.8 63.97 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 116.512 -0.313 . . . . 3.6400000000000001 110.216 -178.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.708 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -70.44 -36.03 68.97 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.215 -0.993 . . . . 0.32000000000000001 111.38 174.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.796 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -69.22 -33.88 74.32 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 110.855 -0.898 . . . . 0.23999999999999999 110.855 173.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.663 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -69.81 -33.61 72.57 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.136 -0.532 . . . . 1.05 110.643 175.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.579 ' HB3' HD12 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -59.19 -39.78 83.67 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.253 1.025 . . . . 1.78 108.625 -179.723 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.631 ' SG ' HG13 ' A' ' 123' ' ' VAL . 35.6 t -53.0 -53.82 44.4 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 113.622 -1.626 . . . . 0.90000000000000002 110.604 173.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.47 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 93.5 t -65.8 -38.44 82.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.261 -0.427 . . . . 1.2 111.07 -178.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.534 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 31.1 mt-10 -56.1 -34.06 65.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.015 0.436 . . . . 2.5099999999999998 110.287 175.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.428 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 45.9 m -74.64 -39.13 62.28 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.412 0.625 . . . . 0.28000000000000003 109.333 178.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 111' ' ' CYS . 91.0 t -66.37 -34.37 69.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.095 -0.957 . . . . 1.8300000000000001 109.565 -179.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -52.12 -48.89 64.57 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.575 -1.648 . . . . 0.59999999999999998 111.196 178.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.428 ' CG ' ' HE2' ' A' ' 119' ' ' MET . 28.7 mmtt -88.05 12.47 13.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.718 -0.674 . . . . 2.1600000000000001 110.419 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.417 ' HA ' HE21 ' A' ' 120' ' ' GLN . 44.9 mt-10 60.11 46.31 10.78 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.876 0.846 . . . . 1.8799999999999999 110.714 -177.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.456 ' HE3' HG22 ' A' ' 74' ' ' ILE . 27.3 mtm -118.69 45.86 1.96 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.462 -1.244 . . . . 1.0800000000000001 107.738 178.376 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.417 HE21 ' HA ' ' A' ' 118' ' ' GLU . 4.5 mt-30 -61.01 -7.28 2.36 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.373 -1.285 . . . . 1.1499999999999999 113.156 -175.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.566 HG21 HD22 ' A' ' 122' ' ' LEU . 28.3 m -66.61 -25.8 35.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 O-C-N 122.025 -0.422 . . . . 1.1899999999999999 111.197 173.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.768 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.4 mm? -71.91 -27.05 62.57 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 110.268 -0.271 . . . . 1.0600000000000001 110.268 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.631 HG13 ' SG ' ' A' ' 111' ' ' CYS . 60.7 t -43.48 -53.6 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 123.777 0.673 . . . . 1.0 112.184 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.575 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 4.8 t -75.11 -34.62 61.73 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.749 -0.38 . . . . 1.6599999999999999 110.542 -179.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.768 ' HD2' HD13 ' A' ' 122' ' ' LEU . 82.4 mtt180 -63.83 -51.6 63.93 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.243 -0.435 . . . . 3.2999999999999998 110.787 -177.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.642 ' O ' ' HB2' ' A' ' 130' ' ' MET . 89.7 mt -54.52 -47.79 70.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.878 -0.601 . . . . 1.0600000000000001 110.663 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.66 ' HB2' HD23 ' A' ' 13' ' ' LEU . . . -56.93 -25.53 57.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.239 -0.437 . . . . 1.1000000000000001 111.962 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.678 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -68.75 -67.03 0.5 Allowed 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 121.117 0.484 . . . . 1.1200000000000001 110.356 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.624 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 37.6 p-90 -75.69 -17.28 60.0 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.318 -0.855 . . . . 4.7699999999999996 111.809 -176.132 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.81 ' HE2' ' HA ' ' A' ' 104' ' ' PHE . 0.3 OUTLIER -65.09 -44.68 88.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.428 . . . . 1.0900000000000001 109.977 173.143 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.459 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -72.65 -38.87 67.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.385 -0.371 . . . . 1.05 110.125 176.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.573 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 38.0 m -59.76 -45.25 92.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.064 -0.517 . . . . 1.1299999999999999 111.678 175.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.418 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 0.7 OUTLIER -56.11 -41.24 74.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.807 0.337 . . . . 3.3500000000000001 110.578 177.693 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.753 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.4 tt -62.52 -50.54 70.98 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.864 -0.791 . . . . 1.5900000000000001 108.864 173.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . 0.409 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 5.2 m-80 -51.26 -48.57 62.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.879 -0.6 . . . . 0.46000000000000002 112.398 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -80.99 -50.42 9.72 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.294 0.479 . . . . 0.58999999999999997 112.294 -175.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . 0.418 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 1.7 m80 -90.64 -51.58 5.32 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.656 0.613 . . . . 2.3399999999999999 112.656 -171.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.753 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -81.47 -46.98 13.76 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.612 0.968 . . . . 1.8999999999999999 113.612 -168.644 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.714 ' HA ' HD11 ' A' ' 142' ' ' ILE . 34.1 tt0 -44.19 -52.92 14.94 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 113.259 0.837 . . . . 0.75 113.259 -172.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 38.8 Cg_exo -59.5 -44.23 33.97 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 121.647 1.565 . . . . 0.87 111.529 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . 0.551 ' CD1' HG11 ' A' ' 95' ' ' VAL . 1.5 t-105 -63.79 -42.93 97.63 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.48 -0.782 . . . . 1.4299999999999999 110.203 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.714 HD11 ' HA ' ' A' ' 139' ' ' GLU . 49.5 mt -48.68 -50.25 13.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.053 0.454 . . . . 1.1299999999999999 111.128 173.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.553 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.5 mm-40 -59.96 -31.79 70.21 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.521 -0.763 . . . . 0.57999999999999996 111.46 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.2 mm-40 -65.14 -19.42 65.97 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.599 0.714 . . . . 0.78000000000000003 110.733 176.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -111.16 5.14 19.85 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.198 -0.91 . . . . 0.93000000000000005 110.408 -175.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 117.17 -42.26 1.9 Allowed Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.626 -0.715 . . . . 0.56000000000000005 113.071 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . 0.564 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 132.8 -176.2 19.61 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.369 -0.92 . . . . 0.48999999999999999 112.343 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.681 ' HZ2' ' HG3' ' A' ' 139' ' ' GLU . 12.9 m-90 -73.16 -47.24 45.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.046 0.451 . . . . 4.5199999999999996 110.495 -177.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -59.85 -41.42 91.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.654 -0.703 . . . . 1.96 110.494 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.589 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 86.3 m -56.1 -35.22 66.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.924 -0.58 . . . . 1.24 111.404 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.954 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 64.4 t80 -61.1 -45.12 96.0 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.875 -0.33 . . . . 3.7200000000000002 110.202 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.577 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -70.49 -24.6 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.474 0.654 . . . . 1.8600000000000001 109.869 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -66.81 -22.99 66.0 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.276 -0.42 . . . . 1.6699999999999999 110.403 173.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.1 mt -98.03 -55.84 2.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.296 0.57 . . . . 1.96 110.88 178.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . 0.411 ' HD2' ' HB1' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -121.7 27.41 8.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.439 -0.8 . . . . 4.3899999999999997 110.416 -170.712 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.668 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -58.14 167.0 6.21 Favored Glycine 0 CA--C 1.503 -0.709 0 CA-C-O 121.834 0.686 . . . . 1.1000000000000001 114.24 -178.042 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . 0.718 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 28.5 t-20 . . . . . 0 C--N 1.312 -1.057 0 CA-C-N 113.68 -1.26 . . . . 1.29 111.224 -177.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.405 0 N-CA-C 113.977 0.351 . . . . 1.26 113.977 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B 1006 ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' B' 1009 ' ' ALA . 18.4 mmt180 -107.38 -37.04 6.34 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.672 0.619 . . . . 3.4500000000000002 112.672 177.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -71.34 -61.6 1.71 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.884 0.698 . . . . 1.54 112.884 -165.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.569 ' H ' HD23 ' B' 1008 ' ' LEU . 1.9 mm? -61.86 -41.96 98.47 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.138 -0.689 . . . . 1.8999999999999999 109.138 -177.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 0.735 ' HA ' HH12 ' A' ' 99' ' ' ARG . . . -38.48 -56.87 1.22 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.333 -1.303 . . . . 1.45 111.645 169.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -73.51 -42.58 61.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.535 -1.211 . . . . 1.51 112.005 -174.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -70.86 -20.79 62.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.062 -0.517 . . . . 2.0699999999999998 111.476 -177.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -75.52 -23.39 73.31 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.841 -0.695 . . . . 0.80000000000000004 112.928 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.75 -19.51 62.53 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.988 0.423 . . . . 1.8999999999999999 111.09 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 18.6 m . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 116.335 -0.393 . . . . 1.4399999999999999 111.2 -173.978 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.7 tp60 . . . . . 0 CA--C 1.53 0.176 0 CA-C-O 121.333 0.587 . . . . 2.7599999999999998 110.714 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.5 p -71.12 -12.33 61.44 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.975 -0.557 . . . . 1.54 111.388 -179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.869 ' HA ' HD21 ' A' ' 8' ' ' LEU . 3.4 p30 -66.29 -25.39 66.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.817 -0.628 . . . . 1.78 111.043 176.283 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.634 ' NH1' ' HB ' ' A' ' 30' ' ' VAL . 15.0 tpp85 -55.62 -50.37 70.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.933 -0.576 . . . . 1.8999999999999999 110.618 175.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.51 ' CD ' ' HG ' ' A' ' 43' ' ' SER . 34.7 mt-10 -59.41 -49.51 77.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.444 -0.798 . . . . 0.68000000000000005 111.007 -176.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.869 HD21 ' HA ' ' A' ' 5' ' ' ASN . 0.1 OUTLIER -47.73 -39.45 17.75 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.102 -0.954 . . . . 1.8 111.287 176.874 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.3 t -73.13 -62.08 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.122 0.487 . . . . 1.0700000000000001 110.253 176.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 6' ' ' ARG . 86.1 t -49.88 -49.15 21.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.17 -0.923 . . . . 1.1299999999999999 113.092 -176.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -53.72 -37.21 63.09 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.797 0.332 . . . . 0.58999999999999997 110.845 -176.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.593 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 21.5 t80 -78.47 -44.2 25.18 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.293 -0.412 . . . . 2.02 111.007 -178.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.804 HD22 ' HB2' ' A' ' 127' ' ' ALA . 6.1 mp -58.03 -42.7 85.88 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 120.435 -0.506 . . . . 1.0600000000000001 109.905 177.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.1 t -58.95 -44.91 91.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.79 -0.641 . . . . 1.6000000000000001 110.594 177.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.423 ' O ' ' HB3' ' A' ' 18' ' ' SER . 61.3 t80 -69.18 -29.61 67.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.971 -0.559 . . . . 1.49 110.844 -178.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.639 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 9.5 mmpt? -74.58 -32.24 62.32 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 120.666 0.27 . . . . 1.8400000000000001 110.879 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.613 HD23 ' O ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -68.4 -28.17 66.86 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 120.283 -0.567 . . . . 1.98 109.626 174.737 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.423 ' HB3' ' O ' ' A' ' 15' ' ' TYR . 45.1 t -62.5 -36.17 81.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.651 -0.704 . . . . 1.3799999999999999 112.06 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -79.07 -0.01 29.71 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.367 0.604 . . . . 1.51 111.243 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.584 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 19.9 mmmt -112.97 -28.66 7.63 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.783 0.801 . . . . 2.6499999999999999 109.09 178.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.36 21.1 11.02 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.119 -1.401 . . . . 0.54000000000000004 111.569 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.584 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 94.4 m-85 -110.2 167.24 10.34 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.571 -0.314 . . . . 1.1200000000000001 110.24 178.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.573 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 6.6 t -111.47 149.97 30.56 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.034 0.445 . . . . 0.75 110.866 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.569 ' HZ2' ' HG2' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -65.47 -50.4 65.48 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.474 -0.785 . . . . 4.29 110.379 173.555 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.9 t -70.42 -24.63 62.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 1.8600000000000001 111.588 -172.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.573 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 92.7 mt-30 -57.7 -32.29 67.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.006 0.432 . . . . 1.52 110.997 177.535 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.497 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 16.4 m-85 -114.76 -16.44 11.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.1 -0.5 . . . . 1.53 111.674 -173.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.6 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 24.8 m -100.97 152.04 21.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.721 0.772 . . . . 2.04 112.661 -175.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.443 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 2.7 t70 -127.81 -8.69 5.54 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.244 -1.344 . . . . 2.3100000000000001 109.842 -177.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.678 HG22 ' H ' ' A' ' 31' ' ' GLU . 3.3 m -51.39 -72.88 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.196 -1.365 . . . . 1.4099999999999999 113.041 -169.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.678 ' H ' HG22 ' A' ' 30' ' ' VAL . 1.7 pm0 -100.57 3.04 42.38 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.089 0.471 . . . . 2.7400000000000002 110.337 174.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.443 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 19.7 tt0 . . . . . 0 C--O 1.234 0.239 0 CA-C-N 115.618 -0.719 . . . . 1.45 111.324 178.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.919 HG22 ' H ' ' A' ' 42' ' ' GLU . 1.8 t . . . . . 0 CA--C 1.538 0.514 0 N-CA-C 109.961 -0.385 . . . . 1.45 109.961 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.919 ' H ' HG22 ' A' ' 41' ' ' THR . 11.2 pt-20 -94.98 -29.05 14.83 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 122.96 1.362 . . . . 2.02 108.211 164.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.51 ' HG ' ' CD ' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -62.91 -26.3 68.73 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 112.021 -2.354 . . . . 1.25 114.107 -166.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -55.56 -42.23 74.4 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.918 -0.313 . . . . 1.9099999999999999 110.411 -179.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.509 ' HB2' HG22 ' A' ' 152' ' ' VAL . . . -79.48 -37.33 37.03 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.97 0.414 . . . . 1.1799999999999999 110.354 176.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.65 ' HA ' ' CG1' ' A' ' 152' ' ' VAL . 99.7 t -58.11 -60.96 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.683 -0.69 . . . . 2.0099999999999998 111.353 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.469 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 10.6 ptpt -59.41 -34.62 72.69 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.365 -0.605 . . . . 1.3799999999999999 109.365 -178.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.519 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 4.7 mm100 -66.59 -32.44 73.78 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.439 -0.801 . . . . 0.98999999999999999 111.01 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.719 ' HB3' ' HA2' ' A' ' 156' ' ' GLY . . . -82.88 -35.02 26.55 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.303 0.573 . . . . 1.1399999999999999 110.3 176.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.445 HD12 ' CE2' ' A' ' 151' ' ' PHE . 1.1 tp -63.06 -31.38 72.51 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.245 -0.889 . . . . 1.95 111.468 -177.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.519 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 9.5 ptp180 -79.05 -30.24 43.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.661 0.743 . . . . 2.5099999999999998 109.098 -178.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.648 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.4 mm-40 -68.9 -47.93 64.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.58 -1.191 . . . . 1.1000000000000001 109.799 177.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.2 -36.8 82.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.427 -0.806 . . . . 1.04 110.073 174.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.695 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.73 -44.05 98.4 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.46 -0.791 . . . . 0.69999999999999996 112.144 179.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.476 ' O ' HD22 ' A' ' 59' ' ' LEU . 23.9 t70 -55.2 -39.65 69.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.785 0.326 . . . . 1.04 110.774 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -65.38 -26.45 68.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.36 -0.836 . . . . 2.29 111.658 178.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -82.84 -33.51 27.09 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.516 -0.311 . . . . 2.9300000000000002 111.205 175.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.766 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 38.2 mt-10 -69.4 -53.37 19.76 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 112.374 0.509 . . . . 1.3 112.374 -165.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.479 HD21 ' N ' ' A' ' 59' ' ' LEU . 2.3 pt? -52.31 -35.18 49.99 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 123.608 0.568 . . . . 2.1899999999999999 110.477 -177.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 75.7 mtt180 -61.4 -58.86 6.48 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.424 -0.807 . . . . 3.1400000000000001 112.055 -178.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.766 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 8.9 p90 -91.32 -6.57 52.9 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.028 0.381 . . . . 5.5899999999999999 112.028 -173.255 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.483 ' HB2' ' O ' ' A' ' 58' ' ' GLU . 17.7 tpp85 -62.84 -30.77 71.75 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.95 0.352 . . . . 4.9299999999999997 111.95 -171.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -65.16 -39.88 93.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.907 0.384 . . . . 5.3499999999999996 110.196 178.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.444 ' HB1' ' CD1' ' A' ' 68' ' ' LEU . . . -77.21 -41.27 41.98 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.025 -0.534 . . . . 1.7 110.858 176.563 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.679 ' CZ ' ' HB3' ' A' ' 109' ' ' ALA . 39.4 t80 -43.42 -47.94 7.06 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.959 0.725 . . . . 3.52 112.959 -174.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.3 p -60.01 -37.17 78.95 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.785 0.326 . . . . 2.5899999999999999 111.627 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -86.49 -29.62 22.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.311 0.576 . . . . 2.7200000000000002 110.642 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.444 ' CD1' ' HB1' ' A' ' 64' ' ' ALA . 2.0 mp -59.73 -16.87 30.44 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.27 -0.877 . . . . 2.25 112.596 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.487 ' CG2' ' HG3' ' A' ' 113' ' ' GLU . 2.2 p -57.88 -27.81 63.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.839 0.291 . . . . 1.26 111.686 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -71.99 -33.75 68.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.652 0.739 . . . . 1.8 109.327 174.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -77.03 -38.39 52.97 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.123 -0.944 . . . . 1.8899999999999999 110.036 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.66 HD21 ' HZ ' ' A' ' 106' ' ' PHE . 3.1 mm? -65.87 -32.87 74.63 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.559 -0.292 . . . . 1.98 110.514 172.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.406 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 59.7 m80 63.25 41.08 8.17 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.332 -0.988 . . . . 3.54 108.332 -172.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.526 HG22 ' HB3' ' A' ' 113' ' ' GLU . 31.5 mm -46.71 115.22 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 113.975 -1.466 . . . . 1.1499999999999999 112.057 -177.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.727 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.15 -174.83 0.45 Allowed Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 114.746 -1.115 . . . . 1.1200000000000001 108.117 -168.234 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.727 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 23.4 Cg_exo -30.3 166.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 125.166 3.911 . . . . 0.53000000000000003 115.001 165.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.596 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -28.82 -34.01 0.01 OUTLIER Glycine 0 N--CA 1.469 0.895 0 N-CA-C 116.931 1.532 . . . . 0.40999999999999998 116.931 -170.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.448 ' N ' ' O ' ' A' ' 76' ' ' PRO . 22.2 p -62.32 3.87 0.17 Allowed 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.893 0.701 . . . . 1.22 112.893 -179.383 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.54 -13.16 62.19 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.207 0.527 . . . . 1.0700000000000001 109.927 172.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.596 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 10.5 p90 -75.91 -18.29 59.44 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.526 -0.546 . . . . 4.3099999999999996 109.526 174.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.444 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 24.2 mt-30 -77.57 -32.55 53.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.878 0.847 . . . . 1.03 109.135 172.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.9 m -68.37 -52.28 34.89 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.283 -1.326 . . . . 0.47999999999999998 109.797 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.48 ' HA ' HG22 ' A' ' 86' ' ' VAL . 78.7 t80 -68.99 -17.97 63.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.046 -0.979 . . . . 1.4399999999999999 110.349 176.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.572 ' HA ' HG12 ' A' ' 87' ' ' VAL . 44.3 tt0 -64.47 -48.78 73.97 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.02 -0.536 . . . . 0.80000000000000004 110.502 177.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -46.48 -35.45 5.67 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.715 -1.13 . . . . 1.99 110.302 176.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.729 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.4 t -81.47 -54.82 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.018 0 CA-C-N 114.455 -1.248 . . . . 1.8999999999999999 111.069 -176.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.572 HG12 ' HA ' ' A' ' 84' ' ' GLU . 10.6 p -58.11 -26.39 29.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.591 0.71 . . . . 1.4299999999999999 109.567 -178.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.479 ' O ' ' HB3' ' A' ' 92' ' ' ARG . 2.3 m-80 -68.07 -40.87 82.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.521 -1.218 . . . . 0.91000000000000003 111.833 175.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.946 ' HG2' ' HA2' ' B' 1005 ' ' GLY . 0.3 OUTLIER -79.41 -33.54 42.59 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-O 121.691 0.758 . . . . 2.8700000000000001 109.756 179.259 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.808 HD23 HH11 ' A' ' 99' ' ' ARG . 42.3 mt -68.31 -22.22 64.72 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 114.392 -1.277 . . . . 1.9199999999999999 112.146 -168.304 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.558 ' HD1' ' O ' ' A' ' 87' ' ' VAL . 6.2 p90 -108.75 -24.76 11.16 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.719 -0.392 . . . . 2.9700000000000002 111.93 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.59 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -68.45 -25.69 65.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.823 0.344 . . . . 5.6699999999999999 111.685 -171.719 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.427 ' HB3' ' NH2' ' A' ' 99' ' ' ARG . 26.8 t70 -97.61 -1.27 44.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.198 -0.456 . . . . 3.1200000000000001 111.945 -170.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.03 67.86 0.11 Allowed Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 118.847 -1.644 . . . . 2.3100000000000001 113.335 -176.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.58 HG12 ' CD1' ' A' ' 141' ' ' TRP . 0.2 OUTLIER -70.54 100.61 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 123.045 1.402 . . . . 1.6799999999999999 110.85 -177.485 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.411 ' H ' ' ND2' ' A' ' 96' ' ' ASN . 0.2 OUTLIER -110.19 -171.53 1.85 Allowed 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 113.124 -1.853 . . . . 2.1200000000000001 108.782 172.108 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.692 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 16.0 m-90 -46.09 -52.37 12.17 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.732 0.645 . . . . 4.1200000000000001 110.964 178.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.43 -28.14 73.26 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.362 -0.835 . . . . 0.80000000000000004 114.414 -175.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.808 HH11 HD23 ' A' ' 90' ' ' LEU . 12.7 mmt180 -72.22 -38.0 69.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.156 0.478 . . . . 4.9100000000000001 111.176 -175.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.55 HG12 ' HG ' ' A' ' 138' ' ' LEU . 94.1 mt -70.29 -33.06 52.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.725 -0.67 . . . . 1.1100000000000001 110.404 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.489 HG21 ' O ' ' A' ' 97' ' ' TRP . 47.0 t -56.31 -54.59 26.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.356 -0.838 . . . . 2.0299999999999998 109.935 170.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -51.1 -47.58 61.9 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.774 -0.648 . . . . 1.0600000000000001 111.013 176.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.557 ' HA ' HD13 ' A' ' 90' ' ' LEU . 11.3 t80 -55.3 -53.1 60.43 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.939 -1.028 . . . . 1.8400000000000001 111.993 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.569 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.2 OUTLIER -76.6 -21.85 55.02 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.794 -0.362 . . . . 4.21 110.685 -175.033 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.593 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 47.1 t -70.08 -54.66 12.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 1.55 110.615 177.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.66 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 41.9 t80 -64.31 -26.6 68.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.039 0.447 . . . . 3.6400000000000001 109.873 178.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.498 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -69.72 -46.96 51.44 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.809 -0.632 . . . . 0.32000000000000001 112.653 178.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.793 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -60.42 -33.46 81.23 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.36 -0.924 . . . . 0.23999999999999999 110.942 175.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.679 ' HB3' ' CZ ' ' A' ' 65' ' ' PHE . . . -72.11 -30.46 65.09 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.023 -0.589 . . . . 1.05 111.01 176.691 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.7 -42.42 99.63 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.731 -0.84 . . . . 1.78 108.731 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.639 ' SG ' HG13 ' A' ' 123' ' ' VAL . 32.9 t -50.32 -53.22 30.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.915 -1.493 . . . . 0.90000000000000002 110.933 174.054 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.534 HG12 ' HG3' ' A' ' 20' ' ' LYS . 53.1 t -62.52 -44.64 99.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.884 -0.598 . . . . 1.2 111.962 -176.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.526 ' HB3' HG22 ' A' ' 74' ' ' ILE . 21.2 mm-40 -60.79 -26.04 66.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.929 0.395 . . . . 2.5099999999999998 111.381 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.53 ' HA ' ' HE1' ' A' ' 119' ' ' MET . 23.7 m -73.35 -38.51 65.72 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.617 -0.883 . . . . 0.28000000000000003 108.617 174.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.61 HG23 ' O ' ' A' ' 111' ' ' CYS . 88.2 t -68.73 -37.36 77.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.257 -0.883 . . . . 1.8300000000000001 109.479 -178.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -55.78 -51.02 68.84 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 113.531 -1.668 . . . . 0.59999999999999998 111.516 -177.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 113' ' ' GLU . 15.0 mmtt -85.79 15.89 4.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.937 -0.574 . . . . 2.1600000000000001 110.071 -178.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.468 ' HA ' HE21 ' A' ' 120' ' ' GLN . 38.4 mt-10 65.19 48.32 2.22 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.524 -0.762 . . . . 1.8799999999999999 110.832 178.33 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.53 ' HE1' ' HA ' ' A' ' 114' ' ' SER . 25.5 mtm -128.15 43.36 3.15 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.044 -1.095 . . . . 1.0800000000000001 108.044 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.577 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 1.6 mt-30 -61.47 -7.69 3.4 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.976 -1.011 . . . . 1.1499999999999999 113.131 -175.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.584 HG23 HD21 ' A' ' 122' ' ' LEU . 25.6 m -66.5 -24.78 33.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 122.042 -0.411 . . . . 1.1899999999999999 111.079 174.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.644 HD11 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -71.7 -27.02 62.74 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 116.537 -0.301 . . . . 1.0600000000000001 110.19 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.639 HG13 ' SG ' ' A' ' 111' ' ' CYS . 65.5 t -45.97 -54.03 2.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 123.735 0.647 . . . . 1.0 112.116 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.6 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 3.4 t -74.95 -26.02 59.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.901 0.381 . . . . 1.6599999999999999 110.491 -177.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.644 ' HD2' HD11 ' A' ' 122' ' ' LEU . 91.4 mtt180 -71.5 -53.15 14.85 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.337 -0.392 . . . . 3.2999999999999998 110.002 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.54 HD11 ' HA ' ' A' ' 111' ' ' CYS . 76.2 mt -54.46 -50.39 58.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.594 -0.73 . . . . 1.0600000000000001 111.532 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.804 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -57.13 -37.07 71.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.871 0.367 . . . . 1.1000000000000001 110.967 179.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -61.52 -56.96 14.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.701 0.762 . . . . 1.1200000000000001 110.241 175.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.516 ' CZ2' ' HB3' ' A' ' 125' ' ' ARG . 36.4 m0 -56.79 -46.51 81.49 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.148 -1.387 . . . . 4.7699999999999996 110.754 -178.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.568 ' SD ' HD11 ' A' ' 13' ' ' LEU . 88.6 mtp -59.36 -54.07 51.0 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.985 -0.552 . . . . 1.0900000000000001 111.459 -177.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.78 -34.24 75.52 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.044 -0.526 . . . . 1.05 110.318 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 54.9 m -65.81 -48.82 70.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.186 -0.461 . . . . 1.1299999999999999 111.004 175.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.499 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 6.5 m-85 -54.56 -42.58 71.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.438 -0.346 . . . . 3.3500000000000001 110.471 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.781 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.7 tt -61.59 -50.53 72.21 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 109.029 -0.73 . . . . 1.5900000000000001 109.029 173.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -50.51 -56.44 11.61 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.247 0.462 . . . . 0.46000000000000002 112.247 179.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.49 -48.23 15.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.069 0.461 . . . . 0.58999999999999997 111.866 -171.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . 0.499 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 52.4 m-70 -90.49 -51.49 5.38 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 112.7 0.63 . . . . 2.3399999999999999 112.7 -170.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.781 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -86.07 -42.59 13.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 114.552 1.315 . . . . 1.8999999999999999 114.552 -165.716 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.648 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 27.5 tt0 -43.85 -51.8 16.38 Favored Pre-proline 0 N--CA 1.47 0.539 0 N-CA-C 112.797 0.666 . . . . 0.75 112.797 -173.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.559 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 47.6 Cg_exo -55.08 -46.06 36.01 Favored 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 121.901 1.734 . . . . 0.87 111.824 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . 0.58 ' CD1' HG12 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -61.39 -41.02 96.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.581 -0.736 . . . . 1.4299999999999999 110.802 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.546 HD11 ' HA ' ' A' ' 139' ' ' GLU . 3.5 mt -54.55 -47.64 71.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.103 0.478 . . . . 1.1299999999999999 110.628 174.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.648 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 67.0 mm-40 -58.24 -34.19 70.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.415 -0.811 . . . . 0.57999999999999996 110.916 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.4 mm-40 -65.19 -23.17 67.02 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 121.46 0.647 . . . . 0.78000000000000003 110.892 178.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.619 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -102.12 2.74 37.8 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.164 -0.926 . . . . 0.93000000000000005 109.315 -174.656 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.6 -44.14 1.53 Allowed Glycine 0 N--CA 1.439 -1.1 0 CA-C-N 114.813 -1.085 . . . . 0.56000000000000005 112.436 177.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 138.66 175.78 14.18 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.728 -0.749 . . . . 0.48999999999999999 111.911 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.403 ' HB3' HG12 ' A' ' 46' ' ' VAL . 5.5 m-90 -68.27 -43.93 76.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.776 0.322 . . . . 4.5199999999999996 110.697 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -63.11 -39.65 95.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.115 -0.493 . . . . 1.96 109.908 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.541 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 94.1 m -56.25 -36.67 68.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.605 -0.725 . . . . 1.24 111.069 177.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.692 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 75.1 t80 -59.98 -42.97 95.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.837 0.351 . . . . 3.7200000000000002 110.277 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.65 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.1 m -73.4 -24.75 20.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.408 0.623 . . . . 1.8600000000000001 110.05 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -64.49 -23.63 67.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.016 0.436 . . . . 1.6699999999999999 109.908 173.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 150' ' ' THR . 1.9 mt -98.52 -53.46 3.32 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.964 -0.562 . . . . 1.96 110.768 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -120.79 26.44 9.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.684 -0.689 . . . . 4.3899999999999997 111.436 -170.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.719 ' HA2' ' HB3' ' A' ' 49' ' ' ALA . . . -57.83 160.2 11.92 Favored Glycine 0 N--CA 1.448 -0.527 0 CA-C-N 116.102 -0.499 . . . . 1.1000000000000001 113.638 -177.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . 0.648 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 28.7 t-20 . . . . . 0 C--N 1.314 -0.972 0 CA-C-N 113.691 -1.254 . . . . 1.29 112.317 -177.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1005 ' ' GLY . . . . . 0.946 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.534 1.252 0 N-CA-C 114.512 0.565 . . . . 1.26 114.512 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -98.87 -27.21 14.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 117.537 0.668 . . . . 3.4500000000000002 112.171 173.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1007 ' ' ALA . . . . . 0.428 ' O ' ' HD2' ' B' 1011 ' ' PHE . . . -91.96 -65.44 1.01 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.235 0.457 . . . . 1.54 112.235 -169.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.595 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 18.2 mt -66.5 -35.91 81.44 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.946 -0.761 . . . . 1.8999999999999999 108.946 -176.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 0.71 ' HA ' HH12 ' A' ' 99' ' ' ARG . . . -42.25 -58.62 2.1 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.681 -1.145 . . . . 1.45 111.351 165.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -72.07 -40.21 68.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.136 -0.938 . . . . 1.51 111.789 -175.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1011 ' ' PHE . . . . . 0.428 ' HD2' ' O ' ' B' 1007 ' ' ALA . 36.9 m-85 -67.65 -24.49 65.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.111 0.481 . . . . 2.0699999999999998 110.397 177.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -79.64 -5.1 89.46 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.681 -0.69 . . . . 0.80000000000000004 112.456 178.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 20.8 t70 -74.85 -22.0 58.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.428 0.632 . . . . 1.8999999999999999 109.685 175.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 28.3 m . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 115.571 -0.74 . . . . 1.4399999999999999 112.33 -173.215 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 37.8 tp60 . . . . . 0 CA--C 1.535 0.393 0 CA-C-O 120.83 0.348 . . . . 2.7599999999999998 111.619 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.413 ' OG ' ' HB3' ' A' ' 43' ' ' SER . 11.7 t -70.63 -15.2 62.71 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.068 0.461 . . . . 1.54 110.563 176.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.795 ' HA ' HD23 ' A' ' 8' ' ' LEU . 7.2 p30 -56.88 -20.83 25.3 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.269 -0.423 . . . . 1.78 111.226 176.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.546 ' O ' HG23 ' A' ' 10' ' ' VAL . 6.8 tpp180 -59.49 -56.2 25.03 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.971 -0.559 . . . . 1.8999999999999999 110.393 174.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.42 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 42.5 mt-10 -57.01 -48.1 79.29 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 115.117 -0.947 . . . . 0.68000000000000005 110.968 -178.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.795 HD23 ' HA ' ' A' ' 5' ' ' ASN . 0.1 OUTLIER -49.17 -31.64 8.76 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.933 -1.031 . . . . 1.8 111.592 178.75 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.531 HG22 ' N ' ' A' ' 131' ' ' ALA . 78.3 t -81.04 -63.01 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-O 121.555 0.693 . . . . 1.0700000000000001 109.897 172.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 6' ' ' ARG . 55.2 t -54.18 -46.93 67.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.565 -1.198 . . . . 1.1299999999999999 113.066 -171.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -56.17 -38.99 71.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.66 0.267 . . . . 0.58999999999999997 110.979 -177.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.702 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 14.7 t80 -71.96 -42.19 66.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.302 -0.408 . . . . 2.02 110.217 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 1.009 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.5 mp -60.53 -41.18 93.92 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 120.499 -0.48 . . . . 1.0600000000000001 109.952 176.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.462 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 23.0 t -61.2 -47.39 86.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 1.6000000000000001 110.489 178.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -62.4 -30.95 71.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.78 -0.646 . . . . 1.49 110.738 177.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.698 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.4 OUTLIER -81.24 -33.83 32.55 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-N 116.109 -0.496 . . . . 1.8400000000000001 112.276 -173.815 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.582 ' O ' ' HD3' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -62.23 -27.73 69.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.371 0.605 . . . . 1.98 110.024 174.509 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.4 t -71.39 -16.25 62.4 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.627 -0.715 . . . . 1.3799999999999999 111.56 -176.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.698 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 19.7 pt20 -79.19 -12.76 59.97 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.356 0.598 . . . . 1.51 111.506 -176.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.753 ' NZ ' HG11 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -115.51 -20.05 10.37 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 122.197 0.999 . . . . 2.6499999999999999 109.412 179.415 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.28 28.97 5.59 Favored Glycine 0 C--N 1.306 -1.101 0 CA-C-N 113.696 -1.593 . . . . 0.54000000000000004 112.931 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -112.77 168.41 9.7 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.724 0.297 . . . . 1.1200000000000001 111.06 169.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.486 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 5.6 t -110.57 152.31 26.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.341 -0.391 . . . . 0.75 110.743 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.482 ' HA ' HD23 ' A' ' 17' ' ' LEU . 0.5 OUTLIER -75.19 -46.7 32.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.972 -0.558 . . . . 4.29 110.279 173.094 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.411 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 13.2 p -65.85 -25.34 67.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.358 -0.383 . . . . 1.8600000000000001 111.5 -173.366 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.486 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 97.3 mt-30 -63.43 -30.29 71.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.931 0.396 . . . . 1.52 111.051 176.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -121.85 18.51 11.01 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.052 -0.522 . . . . 1.53 111.777 -173.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.411 ' OG ' ' HA ' ' A' ' 25' ' ' SER . 93.3 p -101.02 -178.68 3.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.912 0.863 . . . . 2.04 113.156 -171.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.517 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.3 t70 -165.34 -25.52 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.586 -1.643 . . . . 2.3100000000000001 108.43 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.662 HG23 ' H ' ' A' ' 31' ' ' GLU . 15.2 m -55.29 -72.12 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 114.1 -1.409 . . . . 1.4099999999999999 113.014 -174.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.662 ' H ' HG23 ' A' ' 30' ' ' VAL . 34.8 mt-10 -90.17 0.03 57.38 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.759 0.79 . . . . 2.7400000000000002 108.873 177.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.517 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 30.8 tt0 . . . . . 0 N--CA 1.443 -0.785 0 CA-C-N 114.53 -1.214 . . . . 1.45 110.453 -178.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.66 HG22 ' OE2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.514 0 N-CA-C 110.147 -0.316 . . . . 1.45 110.147 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.66 ' OE2' HG22 ' A' ' 41' ' ' THR . 0.0 OUTLIER -94.18 -32.85 13.54 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.806 0.812 . . . . 2.02 109.814 170.222 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.783 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 5.4 p -56.63 -36.29 69.3 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 113.94 -1.482 . . . . 1.25 113.613 -171.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -46.14 -43.65 15.14 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 123.311 0.382 . . . . 1.9099999999999999 111.894 -173.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.473 ' HB3' HG23 ' A' ' 152' ' ' VAL . . . -83.42 -36.86 23.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.777 0.322 . . . . 1.1799999999999999 110.482 176.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.653 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 79.0 t -54.91 -66.58 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 CA-C-N 115.753 -0.658 . . . . 2.0099999999999998 111.174 177.042 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.783 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.8 ptpt -58.26 -37.99 76.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.783 -0.644 . . . . 1.3799999999999999 110.353 -177.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.683 HE21 ' ND2' ' A' ' 157' ' ' ASN . 7.2 mm100 -63.84 -26.38 68.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.645 -0.707 . . . . 0.98999999999999999 111.402 175.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.545 ' HB1' ' HA2' ' A' ' 156' ' ' GLY . . . -84.97 -32.03 23.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.437 0.637 . . . . 1.1399999999999999 109.819 177.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 9.8 mt -67.91 -21.46 65.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.054 -0.976 . . . . 1.95 111.216 -175.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.582 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 13.0 ptp180 -89.73 -35.31 15.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.574 0.702 . . . . 2.5099999999999998 109.485 -178.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.697 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.0 mm-40 -67.65 -46.13 73.32 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.789 -1.096 . . . . 1.1000000000000001 109.396 175.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -71.44 -33.19 69.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.416 -0.811 . . . . 1.04 110.325 176.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.634 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -63.26 -43.63 98.21 Favored Glycine 0 CA--C 1.507 -0.463 0 CA-C-N 115.896 -0.593 . . . . 0.69999999999999996 111.759 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.601 ' O ' HD21 ' A' ' 59' ' ' LEU . 28.5 t70 -56.54 -34.74 67.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.873 0.368 . . . . 1.04 110.735 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -68.28 -26.85 65.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.288 -0.869 . . . . 2.29 111.72 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -83.25 -39.19 21.2 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.117 -0.492 . . . . 2.9300000000000002 111.352 176.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.754 ' HA ' ' CE2' ' A' ' 61' ' ' TYR . 43.6 mt-10 -66.97 -53.39 32.08 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 112.892 0.701 . . . . 1.3 112.892 -166.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.601 HD21 ' O ' ' A' ' 55' ' ' ASP . 2.3 pt? -51.31 -35.04 35.99 Favored 'General case' 0 C--N 1.32 -0.676 0 O-C-N 123.787 0.68 . . . . 2.1899999999999999 111.021 -172.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.414 ' H ' HD23 ' A' ' 59' ' ' LEU . 79.8 mtt-85 -64.82 -52.35 57.23 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.213 -0.903 . . . . 3.1400000000000001 111.621 -178.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.754 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 16.4 p90 -91.62 -14.43 30.2 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.082 0.401 . . . . 5.5899999999999999 112.082 -174.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -60.06 -17.29 38.32 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.029 0.381 . . . . 4.9299999999999997 112.029 -170.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -61.54 -36.64 81.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.016 0.436 . . . . 5.3499999999999996 110.72 177.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.605 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -91.43 -24.1 19.82 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.018 0.377 . . . . 1.7 112.018 -179.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.523 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 55.0 t80 -40.99 -52.97 3.07 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.621 0.971 . . . . 3.52 113.621 -171.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.0 t -69.09 -23.4 64.0 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.904 0.383 . . . . 2.5899999999999999 111.25 -172.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -89.97 -28.56 19.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.307 -0.406 . . . . 2.7200000000000002 111.14 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 48.6 mt -70.69 -18.49 62.82 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 112.455 0.539 . . . . 2.25 112.455 -173.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.513 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 2.1 p -55.21 -37.21 66.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.095 0.474 . . . . 1.26 111.189 -178.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 28.2 t -61.42 -35.47 77.64 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.599 -0.728 . . . . 1.8 109.983 175.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -80.6 -35.44 34.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.336 -0.847 . . . . 1.8899999999999999 110.616 -177.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.497 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.4 mm? -65.61 -33.12 75.17 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.784 -0.45 . . . . 1.98 109.784 172.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.477 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 57.6 m-70 67.81 42.63 1.91 Allowed 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 108.254 -1.017 . . . . 3.54 108.254 -172.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.664 HG22 ' HE1' ' A' ' 119' ' ' MET . 28.4 mm -53.32 114.95 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 114.039 -1.437 . . . . 1.1499999999999999 111.114 179.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.781 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.76 -168.72 0.21 Allowed Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 107.369 -1.345 . . . . 1.1200000000000001 107.369 -171.504 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.781 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 71.6 Cg_exo -28.96 165.79 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.507 3.471 . . . . 0.53000000000000003 115.183 163.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.61 -26.54 0.0 OUTLIER Glycine 0 N--CA 1.475 1.291 0 N-CA-C 118.258 2.063 . . . . 0.40999999999999998 118.258 -171.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.47 ' N ' ' O ' ' A' ' 76' ' ' PRO . 45.4 p -69.29 6.49 0.99 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.493 1.146 . . . . 1.22 112.125 -179.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.93 -12.48 61.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.286 0.565 . . . . 1.0700000000000001 110.237 173.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -77.52 -19.75 55.3 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.261 -0.644 . . . . 4.3099999999999996 109.261 175.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.44 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 30.3 mt-30 -84.39 -20.8 31.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.867 0.841 . . . . 1.03 109.687 173.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.0 m -74.42 -51.6 14.49 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 114.502 -1.226 . . . . 0.47999999999999998 109.094 170.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.719 ' HA ' HG22 ' A' ' 86' ' ' VAL . 66.6 t80 -66.27 -17.91 65.03 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.991 -1.004 . . . . 1.4399999999999999 110.149 175.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.518 ' HA ' HG11 ' A' ' 87' ' ' VAL . 32.1 tt0 -59.47 -51.31 70.4 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-O 121.624 0.726 . . . . 0.80000000000000004 109.869 178.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.471 ' HG2' ' H ' ' A' ' 85' ' ' GLN . 55.4 mm-40 -48.22 -32.64 7.42 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 113.456 -1.702 . . . . 1.99 110.706 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.719 HG22 ' HA ' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -89.06 -51.36 12.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 113.961 -1.472 . . . . 1.8999999999999999 111.25 -175.413 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.518 HG11 ' HA ' ' A' ' 84' ' ' GLU . 7.9 p -60.96 -22.17 26.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-O 121.824 0.821 . . . . 1.4299999999999999 109.372 -177.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.442 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 5.1 m-80 -77.45 -36.91 52.52 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 113.982 -1.463 . . . . 0.91000000000000003 111.858 175.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.953 ' HB2' ' HB3' ' B' 1009 ' ' ALA . 0.0 OUTLIER -83.91 -17.34 41.08 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 121.951 0.882 . . . . 2.8700000000000001 110.284 179.88 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.651 ' HG ' HH11 ' A' ' 99' ' ' ARG . 0.0 OUTLIER -75.43 -50.74 14.9 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 114.98 -1.009 . . . . 1.9199999999999999 110.525 -179.483 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.428 ' HA ' HG23 ' A' ' 95' ' ' VAL . 4.4 p90 -88.36 -23.71 23.31 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.204 0.816 . . . . 2.9700000000000002 113.204 -166.632 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.654 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -58.19 -39.55 79.24 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.454 0.909 . . . . 5.6699999999999999 113.454 -165.23 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.4 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 8.2 p-10 -110.08 22.94 14.97 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 115.113 1.523 . . . . 3.1200000000000001 115.113 -167.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 134.41 73.63 0.08 OUTLIER Glycine 0 C--N 1.318 -0.462 0 C-N-CA 117.457 -2.306 . . . . 2.3100000000000001 115.303 -176.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.62 HG23 HH21 ' A' ' 99' ' ' ARG . 89.0 t -71.72 102.69 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.79 0.805 . . . . 1.6799999999999999 111.56 178.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -112.01 -174.87 2.55 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.784 -1.098 . . . . 2.1200000000000001 109.531 -179.021 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.591 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 18.7 m-90 -59.8 -60.64 3.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.111 0.481 . . . . 4.1200000000000001 110.643 178.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.549 ' O ' ' HB ' ' A' ' 101' ' ' VAL . . . -66.66 -25.84 72.9 Favored Glycine 0 C--N 1.33 0.211 0 CA-C-N 115.647 -0.706 . . . . 0.80000000000000004 112.544 -176.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.651 HH11 ' HG ' ' A' ' 90' ' ' LEU . 1.1 tmm_? -64.67 -39.87 94.43 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.475 -0.565 . . . . 4.9100000000000001 109.475 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.601 HG21 ' CE2' ' A' ' 104' ' ' PHE . 82.9 mt -69.86 -33.14 54.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.266 -0.425 . . . . 1.1100000000000001 110.406 178.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.549 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 91.6 t -51.46 -57.14 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-N 116.002 -0.545 . . . . 2.0299999999999998 110.44 170.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -47.76 -41.84 24.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.012 -0.994 . . . . 1.0600000000000001 111.52 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.462 ' HB3' ' O ' ' A' ' 100' ' ' ILE . 27.5 t80 -60.29 -43.1 96.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.999 -1.001 . . . . 1.8400000000000001 110.934 178.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.73 ' HA ' ' HE2' ' A' ' 130' ' ' MET . 37.4 m-85 -68.41 -37.64 80.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.325 . . . . 4.21 110.565 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.702 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 16.2 m -61.82 -54.88 36.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.861 -0.609 . . . . 1.55 111.071 -176.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -72.56 -31.04 64.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.823 0.344 . . . . 3.6400000000000001 110.281 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.635 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -66.79 -43.73 90.98 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.87 -0.681 . . . . 0.32000000000000001 111.81 177.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 1.009 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.85 -29.02 73.39 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.686 -0.769 . . . . 0.23999999999999999 111.189 175.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.523 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -72.7 -34.14 66.93 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.402 -0.399 . . . . 1.05 110.244 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.508 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.3 OUTLIER -65.57 -34.64 78.72 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.933 0.873 . . . . 1.78 109.996 -179.072 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.678 ' O ' HG21 ' A' ' 115' ' ' VAL . 43.0 t -51.89 -50.04 61.83 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.268 -1.333 . . . . 0.90000000000000002 109.369 171.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.753 HG11 ' NZ ' ' A' ' 20' ' ' LYS . 97.1 t -64.9 -36.24 77.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 116.268 -0.424 . . . . 1.2 110.527 176.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.513 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 37.5 mt-10 -54.65 -37.63 65.93 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.073 0.463 . . . . 2.5099999999999998 110.341 175.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 21.1 m -78.85 -38.79 37.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.983 -0.553 . . . . 0.28000000000000003 109.995 -178.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.678 HG21 ' O ' ' A' ' 111' ' ' CYS . 93.6 t -68.53 -33.26 59.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.716 0.77 . . . . 1.8300000000000001 109.197 -177.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -55.67 -50.13 71.08 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 113.757 -1.565 . . . . 0.59999999999999998 111.575 -178.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.426 ' HB2' ' HE3' ' A' ' 119' ' ' MET . 29.0 mmtt -87.5 13.48 10.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.932 -0.576 . . . . 2.1600000000000001 110.211 -178.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.574 ' HA ' HE21 ' A' ' 120' ' ' GLN . 20.9 mm-40 63.88 52.02 2.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.821 0.819 . . . . 1.8799999999999999 111.502 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.664 ' HE1' HG22 ' A' ' 74' ' ' ILE . 25.9 mtm -130.64 48.37 2.42 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.751 -1.203 . . . . 1.0800000000000001 107.751 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.574 HE21 ' HA ' ' A' ' 118' ' ' GLU . 4.7 mp0 -64.17 -8.26 11.75 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 114.756 -1.111 . . . . 1.1499999999999999 112.4 -173.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.611 HG23 HD21 ' A' ' 122' ' ' LEU . 28.2 m -64.62 -19.66 25.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.808 0.337 . . . . 1.1899999999999999 111.575 176.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.611 HD21 HG23 ' A' ' 121' ' ' VAL . 3.1 mm? -79.81 -24.29 41.5 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.468 -0.333 . . . . 1.0600000000000001 110.146 178.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.66 HG13 ' SG ' ' A' ' 111' ' ' CYS . 56.7 t -46.93 -56.72 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 O-C-N 123.658 0.599 . . . . 1.0 111.849 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.404 ' OG ' HG12 ' A' ' 30' ' ' VAL . 6.6 t -71.1 -29.84 65.79 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.712 -0.395 . . . . 1.6599999999999999 110.275 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.597 ' HD3' HD12 ' A' ' 122' ' ' LEU . 17.2 mtp180 -65.1 -58.51 5.85 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 116.283 -0.417 . . . . 3.2999999999999998 110.857 178.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.458 HD12 ' HA ' ' A' ' 111' ' ' CYS . 79.2 mt -49.93 -49.9 20.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.58 -0.737 . . . . 1.0600000000000001 110.565 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.658 ' HB2' HD23 ' A' ' 13' ' ' LEU . . . -59.04 -36.49 75.11 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.727 0.299 . . . . 1.1000000000000001 111.528 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.26 -56.69 11.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.504 0.668 . . . . 1.1200000000000001 110.936 177.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.493 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 94.3 m95 -64.47 -35.0 79.53 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.809 -1.087 . . . . 4.7699999999999996 111.182 -176.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.73 ' HE2' ' HA ' ' A' ' 104' ' ' PHE . 1.2 mmm -63.87 -50.5 68.58 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.073 0.463 . . . . 1.0900000000000001 110.824 177.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.531 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -63.48 -34.81 78.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.859 -0.61 . . . . 1.05 110.472 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 69.4 m -64.46 -48.12 76.46 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.165 -0.47 . . . . 1.1299999999999999 110.955 177.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -56.95 -39.56 74.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.814 0.34 . . . . 3.3500000000000001 110.094 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.582 HD11 ' HB2' ' A' ' 5' ' ' ASN . 5.6 tt -60.93 -52.08 66.55 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.702 -0.851 . . . . 1.5900000000000001 108.702 173.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -50.58 -49.09 57.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.742 -0.663 . . . . 0.46000000000000002 112.023 179.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.96 -53.43 6.75 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.028 0.442 . . . . 0.58999999999999997 111.485 -174.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.7 -51.07 5.42 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 112.953 0.723 . . . . 2.3399999999999999 112.953 -169.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 40.6 mt -86.68 -31.57 20.97 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.908 0.707 . . . . 1.8999999999999999 112.908 -163.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.621 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 31.1 tt0 -51.76 -51.95 65.48 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 112.247 0.462 . . . . 0.75 112.247 -173.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.564 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 32.9 Cg_exo -59.48 -46.68 19.79 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 121.621 1.547 . . . . 0.87 111.643 176.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . 0.51 ' CE2' ' HB ' ' A' ' 95' ' ' VAL . 0.5 OUTLIER -53.32 -53.32 52.7 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.658 -0.701 . . . . 1.4299999999999999 110.31 177.787 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.594 HD13 ' HA ' ' A' ' 139' ' ' GLU . 45.5 mt -47.09 -52.79 4.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.446 -0.797 . . . . 1.1299999999999999 111.662 174.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.621 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.3 mm-40 -59.83 -32.01 70.27 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.129 -0.487 . . . . 0.57999999999999996 111.678 -178.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 13.4 mm-40 -64.5 -21.29 66.63 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.482 0.658 . . . . 0.78000000000000003 110.767 177.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -112.68 6.37 18.2 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.212 -0.904 . . . . 0.93000000000000005 110.786 -173.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 118.05 -46.69 1.11 Allowed Glycine 0 N--CA 1.442 -0.928 0 CA-C-N 115.501 -0.772 . . . . 0.56000000000000005 113.099 173.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . 0.542 ' HA2' HG23 ' A' ' 142' ' ' ILE . . . 132.74 -171.68 21.58 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.322 -0.942 . . . . 0.48999999999999999 112.476 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.502 ' NE1' HD12 ' A' ' 142' ' ' ILE . 19.7 m-90 -80.02 -45.92 17.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.96 0.409 . . . . 4.5199999999999996 110.427 -178.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.418 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 18.9 t70 -56.86 -37.88 71.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.412 -0.813 . . . . 1.96 110.018 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.642 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 90.6 m -59.37 -36.65 76.15 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.346 -0.843 . . . . 1.24 111.384 178.468 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.591 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 62.6 t80 -63.63 -35.74 81.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.921 0.391 . . . . 3.7200000000000002 110.493 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.593 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 0.7 OUTLIER -74.51 -25.3 19.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.463 0.649 . . . . 1.8600000000000001 109.67 178.197 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 7.0 mm-40 -70.1 -26.54 64.03 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.736 -0.665 . . . . 1.6699999999999999 109.383 173.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.642 ' HG ' ' O ' ' A' ' 150' ' ' THR . 12.1 mt -83.24 -58.63 2.76 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.545 -0.752 . . . . 1.96 110.338 177.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -114.51 -42.34 3.31 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.597 -0.274 . . . . 4.3899999999999997 110.495 -175.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.545 ' HA2' ' HB1' ' A' ' 49' ' ' ALA . . . 47.54 -156.01 0.94 Allowed Glycine 0 CA--C 1.506 -0.474 0 O-C-N 123.89 0.744 . . . . 1.1000000000000001 114.037 -177.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . 0.697 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 26.3 t-20 . . . . . 0 N--CA 1.43 -1.456 0 CA-C-N 114.844 -0.678 . . . . 1.29 110.113 -176.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.464 0 N-CA-C 114.63 0.612 . . . . 1.26 114.63 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 31.8 mmt180 -105.71 -26.92 11.6 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.371 0.878 . . . . 3.4500000000000002 113.371 178.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -78.68 -61.36 2.04 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.282 0.845 . . . . 1.54 113.282 -165.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.73 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 1.3 mm? -65.31 -44.65 87.2 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.734 -0.839 . . . . 1.8999999999999999 108.734 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 0.953 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . . . -37.25 -52.03 1.05 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.512 -1.222 . . . . 1.45 110.855 169.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -76.75 -46.63 24.51 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 113.807 -1.542 . . . . 1.51 111.918 -174.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -68.67 -24.91 64.58 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.36 -0.382 . . . . 2.0699999999999998 111.042 -178.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -72.72 -14.24 78.07 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.966 -0.561 . . . . 0.80000000000000004 112.464 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 13.3 t70 -64.78 -20.26 66.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.345 0.593 . . . . 1.8999999999999999 110.455 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 15.5 m . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 115.831 -0.622 . . . . 1.4399999999999999 111.889 -177.324 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 . . . . . 0 C--O 1.226 -0.155 0 CA-C-O 121.088 0.47 . . . . 2.7599999999999998 110.468 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 p -63.4 -23.5 67.43 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.623 -0.717 . . . . 1.54 112.028 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.965 ' HA ' HD23 ' A' ' 8' ' ' LEU . 73.1 m-20 -62.62 -28.18 69.73 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.308 0.575 . . . . 1.78 109.806 176.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.537 ' O ' HG22 ' A' ' 10' ' ' VAL . 7.0 tpp180 -60.64 -48.6 81.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.226 -0.897 . . . . 1.8999999999999999 110.22 177.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.587 ' CD ' ' HG ' ' A' ' 43' ' ' SER . 41.9 mt-10 -56.76 -51.45 68.86 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.392 -0.822 . . . . 0.68000000000000005 111.209 -178.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.965 HD23 ' HA ' ' A' ' 5' ' ' ASN . 0.0 OUTLIER -47.62 -42.68 24.76 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.536 -0.756 . . . . 1.8 110.912 177.531 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.472 HG13 ' HA ' ' A' ' 127' ' ' ALA . 73.1 t -68.88 -63.7 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.46 -0.791 . . . . 1.0700000000000001 110.195 176.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.537 HG22 ' O ' ' A' ' 6' ' ' ARG . 97.7 t -49.31 -53.68 8.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.416 -0.811 . . . . 1.1299999999999999 112.979 -176.277 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -57.81 -34.09 69.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.007 0.432 . . . . 0.58999999999999997 110.598 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.747 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.7 t80 -75.79 -46.52 30.25 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.111 -0.495 . . . . 2.02 110.671 -179.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 1.041 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.5 mp -59.87 -42.72 94.33 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 120.787 -0.365 . . . . 1.0600000000000001 110.311 178.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.8 t -60.34 -38.89 85.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.951 -0.568 . . . . 1.6000000000000001 110.47 178.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -71.33 -18.07 62.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.751 -0.659 . . . . 1.49 110.75 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.713 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 10.1 mmpt? -84.86 -46.36 11.4 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 121.368 0.604 . . . . 1.8400000000000001 110.252 -179.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.718 HD23 ' SG ' ' A' ' 111' ' ' CYS . 14.6 mt -55.95 -26.92 50.11 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.125 -0.943 . . . . 1.98 111.276 177.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.6 t -58.55 -35.11 71.81 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.175 -0.921 . . . . 1.3799999999999999 112.522 176.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.713 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 27.8 pt20 -80.43 -7.94 59.34 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.989 0.737 . . . . 1.51 112.989 -170.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.771 ' NZ ' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -111.93 -20.14 12.12 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 122.164 0.983 . . . . 2.6499999999999999 109.238 178.545 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.09 28.1 6.29 Favored Glycine 0 C--N 1.306 -1.134 0 CA-C-N 113.652 -1.613 . . . . 0.54000000000000004 112.741 174.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.527 ' HD1' ' HE3' ' A' ' 20' ' ' LYS . 70.8 m-85 -110.17 166.25 11.11 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.716 0.293 . . . . 1.1200000000000001 110.83 172.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.508 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 4.0 t -110.62 154.98 23.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.341 -0.391 . . . . 0.75 110.554 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.65 ' HZ2' HG23 ' A' ' 30' ' ' VAL . 68.0 t-105 -72.64 -54.5 8.88 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.101 -0.5 . . . . 4.29 110.252 174.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.4 t -62.38 -27.52 69.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.699 -0.682 . . . . 1.8600000000000001 111.776 -173.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.508 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 95.3 mt-30 -59.26 -26.6 65.06 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 111.898 0.333 . . . . 1.52 111.898 178.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -119.94 -10.73 9.42 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.086 0.402 . . . . 1.53 112.086 -173.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.54 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 49.3 m -101.89 179.53 4.3 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 113.627 0.973 . . . . 2.04 113.627 -169.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.413 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 0.8 OUTLIER -156.08 -14.26 0.1 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.376 -1.284 . . . . 2.3100000000000001 110.015 -179.015 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.676 HG21 ' HG3' ' A' ' 31' ' ' GLU . 12.3 m -51.95 -71.56 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.479 -1.237 . . . . 1.4099999999999999 112.76 -169.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.676 ' HG3' HG21 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -99.9 1.22 42.61 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-O 121.54 0.686 . . . . 2.7400000000000002 109.672 177.844 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.413 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.5 tt0 . . . . . 0 N--CA 1.446 -0.655 0 CA-C-N 114.697 -1.138 . . . . 1.45 111.157 -178.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.768 HG21 ' H ' ' A' ' 42' ' ' GLU . 0.6 OUTLIER . . . . . 0 CA--C 1.541 0.6 0 CA-C-O 120.89 0.376 . . . . 1.45 110.46 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.768 ' H ' HG21 ' A' ' 41' ' ' THR . 15.4 pt-20 -93.53 -27.82 16.42 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-O 123.176 1.465 . . . . 2.02 107.908 166.428 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.587 ' HG ' ' CD ' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -66.83 -20.92 66.03 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 111.676 -2.511 . . . . 1.25 113.954 -167.577 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 35.5 tt0 -54.89 -59.84 4.18 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.933 -0.307 . . . . 1.9099999999999999 111.012 -179.201 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.503 ' HB2' HG23 ' A' ' 152' ' ' VAL . . . -64.58 -36.35 83.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.223 0.535 . . . . 1.1799999999999999 110.034 179.195 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.542 ' HA ' ' CG1' ' A' ' 152' ' ' VAL . 99.4 t -59.5 -60.74 2.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 114.917 -1.038 . . . . 2.0099999999999998 111.14 178.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.474 ' HB3' HD12 ' A' ' 8' ' ' LEU . 11.2 ptpt -62.42 -35.13 78.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.624 0.726 . . . . 1.3799999999999999 109.255 -176.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.645 ' NE2' ' HD3' ' A' ' 51' ' ' ARG . 7.1 mm100 -65.95 -32.31 73.73 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.941 -1.027 . . . . 0.98999999999999999 110.826 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.668 ' HB3' ' HA2' ' A' ' 156' ' ' GLY . . . -74.5 -43.88 53.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.13 0.49 . . . . 1.1399999999999999 110.624 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.475 ' O ' ' HE2' ' A' ' 12' ' ' PHE . 8.0 mp -63.25 -26.54 68.83 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.429 -0.805 . . . . 1.95 112.88 -174.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.645 ' HD3' ' NE2' ' A' ' 48' ' ' GLN . 10.4 ptm180 -78.51 -32.41 48.09 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.156 -1.053 . . . . 2.5099999999999998 108.156 -175.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 3.7 mm-40 -80.41 -44.19 19.75 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 113.565 -1.652 . . . . 1.1000000000000001 109.907 -179.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.29 -41.08 98.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.486 -0.779 . . . . 1.04 110.169 175.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.725 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.16 -42.23 98.49 Favored Glycine 0 C--O 1.22 -0.759 0 CA-C-N 115.558 -0.746 . . . . 0.69999999999999996 112.001 177.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.599 ' O ' HD21 ' A' ' 59' ' ' LEU . 29.8 t70 -53.46 -37.78 62.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.948 0.404 . . . . 1.04 111.296 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -71.93 -24.92 61.71 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.729 -0.669 . . . . 2.29 111.863 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -84.01 -44.62 13.96 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 112.103 0.408 . . . . 2.9300000000000002 112.103 174.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.725 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.3 mt-10 -66.02 -46.27 78.48 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.111 0.782 . . . . 1.3 113.111 -164.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.599 HD21 ' O ' ' A' ' 55' ' ' ASP . 2.5 pt? -53.46 -31.22 44.62 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.014 -0.539 . . . . 2.1899999999999999 111.347 -173.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 67.2 mtt-85 -64.93 -53.71 42.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.549 -0.75 . . . . 3.1400000000000001 111.741 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.723 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 15.3 p90 -90.76 -3.8 57.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.595 -0.275 . . . . 5.5899999999999999 111.119 -176.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.4 ttt180 -53.59 -34.87 59.93 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.469 0.544 . . . . 4.9299999999999997 112.469 -172.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -64.77 -33.88 77.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.992 0.425 . . . . 5.3499999999999996 110.761 177.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.545 ' HB3' ' CD1' ' A' ' 68' ' ' LEU . . . -78.37 -28.91 47.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.891 -0.595 . . . . 1.7 110.577 -178.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.564 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 52.7 t80 -44.3 -46.91 9.42 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.543 0.572 . . . . 3.52 112.543 -176.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 36.7 t -62.76 -44.68 95.55 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.894 0.378 . . . . 2.5899999999999999 110.744 -177.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.75 -29.12 40.43 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.104 -0.498 . . . . 2.7200000000000002 111.549 -176.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.736 ' HA ' ' HG3' ' A' ' 71' ' ' GLN . 4.1 mp -61.6 -24.37 66.64 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.677 0.621 . . . . 2.25 112.677 -175.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.453 HG22 HG13 ' A' ' 74' ' ' ILE . 21.2 p -57.73 -29.13 64.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.171 0.51 . . . . 1.26 110.719 178.479 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.5 t -76.8 -38.87 53.17 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.566 -0.743 . . . . 1.8 109.768 176.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.736 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 6.5 mt-30 -65.63 -47.17 76.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.32 -0.854 . . . . 1.8899999999999999 110.161 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.62 HD12 ' HZ ' ' A' ' 106' ' ' PHE . 1.2 mt -74.8 -31.4 61.72 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.753 -0.658 . . . . 1.98 110.545 178.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.468 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 49.2 m80 71.86 54.64 0.19 Allowed 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.563 0.697 . . . . 3.54 109.276 -176.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.516 HG23 ' HE2' ' A' ' 119' ' ' MET . 15.2 mm -58.58 118.47 2.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 114.165 -1.379 . . . . 1.1499999999999999 110.666 -179.732 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.763 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -156.39 -170.41 0.24 Allowed Pre-proline 0 CA--C 1.546 0.827 0 N-CA-C 107.98 -1.118 . . . . 1.1200000000000001 107.98 -169.214 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.763 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 38.4 Cg_exo -29.47 166.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.278 0 C-N-CA 124.814 3.676 . . . . 0.53000000000000003 115.091 163.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -33.24 -24.08 0.01 OUTLIER Glycine 0 N--CA 1.471 1.0 0 N-CA-C 117.259 1.664 . . . . 0.40999999999999998 117.259 -174.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.453 ' N ' ' O ' ' A' ' 76' ' ' PRO . 17.2 p -71.96 6.3 2.17 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 117.994 0.897 . . . . 1.22 112.216 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.57 -12.64 61.56 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.165 0.507 . . . . 1.0700000000000001 110.19 174.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.436 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 1.8 p90 -76.0 -15.13 60.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.013 -0.539 . . . . 4.3099999999999996 109.841 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.446 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 36.3 mt-30 -83.38 -26.31 30.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.451 -0.795 . . . . 1.03 109.793 173.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.517 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.2 m -74.48 -50.12 19.56 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.041 -0.981 . . . . 0.47999999999999998 109.392 172.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.702 ' HA ' HG23 ' A' ' 86' ' ' VAL . 59.1 t80 -65.54 -18.29 65.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.991 -1.004 . . . . 1.4399999999999999 110.06 175.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.566 ' HA ' HG12 ' A' ' 87' ' ' VAL . 37.9 tt0 -62.84 -49.02 76.54 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.258 -0.883 . . . . 0.80000000000000004 110.57 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -48.1 -36.43 13.2 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.716 -1.129 . . . . 1.99 110.125 177.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.775 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.0 OUTLIER -81.37 -54.58 9.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 114.452 -1.249 . . . . 1.8999999999999999 111.026 -176.108 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.566 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.6 p -59.33 -23.45 25.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 122.038 0.923 . . . . 1.4299999999999999 109.396 -177.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.432 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.7 m-80 -71.31 -58.46 3.51 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 113.945 -1.48 . . . . 0.91000000000000003 110.894 172.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 1.045 ' HB2' ' HB1' ' B' 1009 ' ' ALA . 0.0 OUTLIER -62.26 -38.8 90.69 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-O 121.967 0.889 . . . . 2.8700000000000001 109.358 -174.396 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.571 ' HB2' ' O ' ' A' ' 86' ' ' VAL . 1.7 tp -56.12 -30.55 62.25 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 113.194 -1.821 . . . . 1.9199999999999999 110.912 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.552 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 71.6 t80 -94.35 -33.38 13.2 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.488 -0.324 . . . . 2.9700000000000002 111.839 -168.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.91 -45.99 47.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 122.119 0.961 . . . . 5.6699999999999999 110.213 -175.286 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -95.82 20.63 9.61 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 113.803 -1.544 . . . . 3.1200000000000001 112.568 -159.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.474 ' O ' ' HG2' ' A' ' 99' ' ' ARG . . . 130.16 68.56 0.11 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 118.141 -1.981 . . . . 2.3100000000000001 115.757 174.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.645 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 61.2 t -73.04 98.71 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 118.593 1.196 . . . . 1.6799999999999999 110.23 173.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.593 ' ND2' ' HB3' ' A' ' 99' ' ' ARG . 3.3 p30 -111.98 -174.46 2.47 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.537 -1.21 . . . . 2.1200000000000001 109.24 175.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.631 ' HA ' ' CE2' ' A' ' 151' ' ' PHE . 16.1 m-90 -61.68 -45.62 93.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.979 -0.555 . . . . 4.1200000000000001 110.856 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.416 ' O ' HG13 ' A' ' 101' ' ' VAL . . . -77.43 -37.0 32.46 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.905 -0.589 . . . . 0.80000000000000004 113.456 -174.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.662 ' NH2' HD11 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -64.83 -29.14 70.09 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 122.433 -0.451 . . . . 4.9100000000000001 110.524 -177.168 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.56 HG22 ' HE1' ' A' ' 104' ' ' PHE . 45.4 mt -68.58 -36.91 76.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 C-N-CA 120.231 -0.587 . . . . 1.1100000000000001 110.314 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.416 HG13 ' O ' ' A' ' 98' ' ' GLY . 0.6 OUTLIER -59.46 -31.46 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 109.562 -0.532 . . . . 2.0299999999999998 109.562 175.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.74 -35.36 80.5 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.837 -0.62 . . . . 1.0600000000000001 111.06 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.454 ' HB3' ' O ' ' A' ' 100' ' ' ILE . 17.4 t80 -60.95 -32.78 72.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.114 -0.948 . . . . 1.8400000000000001 109.95 177.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.56 ' HE1' HG22 ' A' ' 100' ' ' ILE . 89.1 m-85 -80.27 -35.94 35.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.945 -0.57 . . . . 4.21 110.4 175.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.747 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 20.0 m -61.44 -53.58 54.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.082 -0.508 . . . . 1.55 110.658 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.62 ' HZ ' HD12 ' A' ' 72' ' ' LEU . 32.2 t80 -73.46 -33.61 64.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.06 -0.518 . . . . 3.6400000000000001 110.392 -178.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.471 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -67.93 -44.83 77.29 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.974 -0.631 . . . . 0.32000000000000001 111.835 178.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 1.041 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.22 -31.67 81.37 Favored Glycine 0 N--CA 1.442 -0.914 0 N-CA-C 111.097 -0.801 . . . . 0.23999999999999999 111.097 175.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.564 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -68.52 -34.77 76.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.304 -0.448 . . . . 1.05 109.887 176.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.445 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.2 OUTLIER -64.2 -35.63 81.44 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.909 0.861 . . . . 1.78 110.169 -178.52 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.718 ' SG ' HD23 ' A' ' 17' ' ' LEU . 41.4 t -52.55 -49.16 65.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.51 -1.223 . . . . 0.90000000000000002 109.478 172.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.771 HG13 ' NZ ' ' A' ' 20' ' ' LYS . 94.5 t -64.59 -37.15 79.32 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 CA-C-N 116.272 -0.422 . . . . 1.2 110.557 175.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.477 ' HB3' HG21 ' A' ' 74' ' ' ILE . 46.5 mt-10 -56.44 -34.85 67.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.96 0.41 . . . . 2.5099999999999998 110.965 176.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.406 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 26.6 m -79.34 -36.75 38.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.366 0.603 . . . . 0.28000000000000003 109.715 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.679 HG22 ' O ' ' A' ' 111' ' ' CYS . 98.1 t -69.34 -32.19 52.46 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.993 0.902 . . . . 1.8300000000000001 109.427 -178.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -56.83 -50.05 73.56 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.596 -1.638 . . . . 0.59999999999999998 111.302 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.437 ' CG ' ' HE1' ' A' ' 119' ' ' MET . 35.9 mmtt -85.87 13.8 6.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.795 -0.639 . . . . 2.1600000000000001 110.608 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 62.16 48.45 4.97 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.626 0.727 . . . . 1.8799999999999999 110.497 -178.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.516 ' HE2' HG23 ' A' ' 74' ' ' ILE . 31.4 mtm -126.67 44.09 2.96 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.909 -1.145 . . . . 1.0800000000000001 107.909 -178.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.602 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 12.4 mp0 -61.75 -6.99 2.99 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.927 -1.033 . . . . 1.1499999999999999 113.31 -171.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.513 HG23 HD21 ' A' ' 122' ' ' LEU . 34.2 m -65.55 -25.32 36.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 120.771 0.32 . . . . 1.1899999999999999 111.029 176.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.611 HD11 ' HD2' ' A' ' 125' ' ' ARG . 2.9 mm? -73.89 -25.3 59.95 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 116.563 -0.289 . . . . 1.0600000000000001 110.556 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.713 HG13 ' SG ' ' A' ' 111' ' ' CYS . 53.2 t -44.13 -53.12 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 O-C-N 123.63 0.581 . . . . 1.0 112.211 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.54 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 6.4 t -78.32 -22.2 48.48 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.097 0.475 . . . . 1.6599999999999999 110.687 -177.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.611 ' HD2' HD11 ' A' ' 122' ' ' LEU . 75.1 mtt180 -79.33 -44.87 20.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.093 -0.503 . . . . 3.2999999999999998 110.897 -177.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.672 ' HA ' ' CE3' ' A' ' 129' ' ' TRP . 85.6 mt -56.15 -47.46 80.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.838 -0.619 . . . . 1.0600000000000001 110.781 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.538 ' HB3' ' HH2' ' A' ' 24' ' ' TRP . . . -59.2 -35.95 74.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.818 0.342 . . . . 1.1000000000000001 111.024 178.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.428 ' HB1' ' O ' ' A' ' 125' ' ' ARG . . . -58.1 -58.72 7.17 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.58 0.705 . . . . 1.1200000000000001 110.383 175.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.672 ' CE3' ' HA ' ' A' ' 126' ' ' ILE . 16.6 m0 -56.12 -48.46 76.16 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.22 -1.354 . . . . 4.7699999999999996 110.32 -178.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.534 ' SD ' HG22 ' A' ' 126' ' ' ILE . 91.3 mtp -59.06 -55.02 40.49 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.658 -0.701 . . . . 1.0900000000000001 111.787 -176.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.22 -38.66 87.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.137 -0.483 . . . . 1.05 111.42 -177.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 47.8 m -65.66 -47.21 76.28 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.73 -0.388 . . . . 1.1299999999999999 110.7 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.645 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 5.5 m-85 -56.36 -36.06 68.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.3 -0.409 . . . . 3.3500000000000001 110.529 177.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.838 HD12 ' HZ2' ' A' ' 148' ' ' TRP . 4.2 tt -62.28 -58.38 7.92 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.786 -0.82 . . . . 1.5900000000000001 108.786 170.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -48.38 -45.66 36.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.338 -0.846 . . . . 0.46000000000000002 112.842 -176.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -88.96 -45.81 9.38 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.056 0.391 . . . . 0.58999999999999997 112.056 -175.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . 0.645 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 31.0 m-70 -91.25 -48.98 6.62 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.414 0.524 . . . . 2.3399999999999999 112.414 -170.15 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.747 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -88.52 -44.24 10.82 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 113.819 1.044 . . . . 1.8999999999999999 113.819 -168.603 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.647 ' HA ' HD13 ' A' ' 142' ' ' ILE . 34.8 tt0 -43.44 -53.15 12.09 Favored Pre-proline 0 C--N 1.323 -0.566 0 O-C-N 123.831 0.707 . . . . 0.75 112.8 -174.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.63 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 10.8 Cg_endo -54.37 -49.44 16.92 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 121.857 1.705 . . . . 0.87 111.574 177.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 5.0 t-105 -55.99 -52.99 62.22 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.556 -0.747 . . . . 1.4299999999999999 110.341 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.647 HD13 ' HA ' ' A' ' 139' ' ' GLU . 43.6 mt -46.55 -52.29 3.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.804 -0.634 . . . . 1.1299999999999999 111.812 176.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.611 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.8 mm-40 -60.25 -32.09 70.82 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.766 -0.652 . . . . 0.57999999999999996 111.782 -179.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.63 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.6 mm-40 -65.44 -21.43 66.65 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 121.659 0.742 . . . . 0.78000000000000003 110.464 177.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -107.87 9.57 28.77 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.019 -0.991 . . . . 0.93000000000000005 110.016 -174.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 121.46 -29.37 5.7 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.902 -1.045 . . . . 0.56000000000000005 113.38 171.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 108.64 166.11 20.89 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.649 -0.786 . . . . 0.48999999999999999 111.227 -175.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.838 ' HZ2' HD12 ' A' ' 134' ' ' LEU . 16.9 m95 -57.16 -40.39 77.15 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.82 0.674 . . . . 4.5199999999999996 112.82 -174.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.516 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 9.9 m-20 -55.35 -41.61 72.76 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.303 -0.258 . . . . 1.96 110.303 177.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.594 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 23.4 m -56.58 -38.55 72.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.234 -0.439 . . . . 1.24 111.508 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.631 ' CE2' ' HA ' ' A' ' 97' ' ' TRP . 1.2 m-85 -61.29 -36.77 81.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.543 0.687 . . . . 3.7200000000000002 109.44 -178.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.542 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 0.7 OUTLIER -80.32 -25.41 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 115.382 -0.827 . . . . 1.8600000000000001 110.042 178.115 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 6.6 mm-40 -64.56 -29.73 70.75 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.135 0.493 . . . . 1.6699999999999999 109.902 173.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 150' ' ' THR . 9.5 mt -82.96 -56.44 3.81 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.633 -0.712 . . . . 1.96 110.164 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . 0.409 ' HE2' ' HB2' ' A' ' 52' ' ' GLU . 62.5 t80 -113.48 -44.93 3.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.296 -0.411 . . . . 4.3899999999999997 110.752 -176.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.668 ' HA2' ' HB3' ' A' ' 49' ' ' ALA . . . 43.36 -157.15 0.12 Allowed Glycine 0 CA--C 1.502 -0.746 0 CA-C-O 121.769 0.65 . . . . 1.1000000000000001 113.829 -177.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . 0.607 ' ND2' HE21 ' A' ' 48' ' ' GLN . 27.4 t-20 . . . . . 0 N--CA 1.426 -1.636 0 CA-C-N 114.776 -0.712 . . . . 1.29 109.745 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1005 ' ' GLY . . . . . 0.945 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 N--CA 1.439 -1.165 0 N-CA-C 110.366 -1.094 . . . . 1.26 110.366 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -121.46 -32.29 3.87 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.952 0.501 . . . . 3.4500000000000002 111.878 174.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -82.26 -54.14 5.48 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.256 -0.429 . . . . 1.54 112.114 -167.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.501 ' H ' HD22 ' B' 1008 ' ' LEU . 2.2 mm? -70.03 -31.69 69.45 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.076 -0.713 . . . . 1.8999999999999999 109.076 -177.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 1.045 ' HB1' ' HB2' ' A' ' 89' ' ' GLU . . . -49.89 -45.34 50.66 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.367 -1.288 . . . . 1.45 109.782 172.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -85.23 -49.41 8.22 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 113.178 -1.828 . . . . 1.51 111.498 -174.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -65.58 -23.56 66.87 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.048 -0.524 . . . . 2.0699999999999998 110.498 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.82 -11.35 83.52 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.932 -0.576 . . . . 0.80000000000000004 112.934 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 32.6 t70 -71.84 -15.43 62.13 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.5 0.667 . . . . 1.8999999999999999 109.654 170.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.45 -0.436 0 CA-C-N 115.553 -0.749 . . . . 1.4399999999999999 110.223 -178.723 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 . . . . . 0 CA--C 1.529 0.15 0 CA-C-O 120.917 0.389 . . . . 2.7599999999999998 111.072 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m -82.13 -17.92 44.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.167 -0.469 . . . . 1.54 111.068 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.751 ' HB3' ' CD2' ' A' ' 134' ' ' LEU . 76.2 m-20 -62.64 -22.1 66.18 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 121.218 0.532 . . . . 1.78 109.756 177.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.59 ' HA ' ' HB1' ' A' ' 131' ' ' ALA . 11.7 tpp85 -57.78 -43.53 85.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.276 -0.875 . . . . 1.8999999999999999 110.573 176.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -61.58 -49.16 77.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.71 -0.677 . . . . 0.68000000000000005 111.242 -177.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.738 HD21 ' HA ' ' A' ' 5' ' ' ASN . 0.3 OUTLIER -50.04 -32.99 16.83 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.129 -0.942 . . . . 1.8 111.383 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.413 HG13 ' HA ' ' A' ' 127' ' ' ALA . 79.5 t -79.53 -62.25 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.79 -0.641 . . . . 1.0700000000000001 110.24 173.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.521 HG11 ' CE2' ' A' ' 24' ' ' TRP . 73.2 t -48.58 -54.73 4.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.504 -0.771 . . . . 1.1299999999999999 112.553 -176.159 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -57.08 -37.49 71.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.094 -0.503 . . . . 0.58999999999999997 110.524 -177.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.737 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 19.2 t80 -69.8 -46.49 65.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.939 -0.573 . . . . 2.02 110.501 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 1.055 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.9 mp -62.01 -39.48 92.39 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 120.98 -0.288 . . . . 1.0600000000000001 110.45 178.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.3 m -58.63 -42.21 87.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.395 0.617 . . . . 1.6000000000000001 110.205 176.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -67.47 -17.84 64.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.108 -0.951 . . . . 1.49 111.108 -178.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.611 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.4 mmpt? -85.96 -49.1 8.1 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.525 0.679 . . . . 1.8400000000000001 109.777 -178.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.58 HD21 ' SG ' ' A' ' 111' ' ' CYS . 12.4 mt -59.33 -28.31 66.7 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.965 -1.016 . . . . 1.98 111.26 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.3 t -56.82 -43.88 81.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.427 -0.806 . . . . 1.3799999999999999 111.678 177.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 12.4 pt20 -80.64 2.02 27.53 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.995 0.426 . . . . 1.51 111.587 -178.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.716 ' HE2' HG12 ' A' ' 112' ' ' VAL . 20.7 mmmt -107.39 -28.54 9.79 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.913 0.863 . . . . 2.6499999999999999 109.032 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 22.25 10.4 Favored Glycine 0 N--CA 1.441 -0.999 0 CA-C-N 113.888 -1.505 . . . . 0.54000000000000004 111.576 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -113.61 161.73 17.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.862 0.363 . . . . 1.1200000000000001 110.691 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.3 t -102.33 145.94 28.75 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.998 -0.546 . . . . 0.75 110.259 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.735 ' HZ2' HG23 ' A' ' 30' ' ' VAL . 48.2 t-105 -75.09 -51.77 12.68 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.598 -0.728 . . . . 4.29 109.192 174.471 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.8 m -60.01 -34.48 73.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.378 -0.828 . . . . 1.8600000000000001 111.976 -174.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -61.45 -28.78 69.52 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.781 0.325 . . . . 1.52 111.536 -179.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -120.85 19.06 11.8 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.192 -0.458 . . . . 1.53 111.253 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.533 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 53.7 p -99.81 -178.72 3.95 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.592 0.71 . . . . 2.04 112.034 -172.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.524 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.0 OUTLIER -165.43 -25.69 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.429 -1.26 . . . . 2.3100000000000001 109.304 -179.364 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.735 HG23 ' HZ2' ' A' ' 24' ' ' TRP . 10.7 m -50.63 -71.89 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 114.387 -1.279 . . . . 1.4099999999999999 112.864 -173.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.658 ' H ' HG21 ' A' ' 30' ' ' VAL . 9.0 pt-20 -94.82 0.38 54.82 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.929 -0.767 . . . . 2.7400000000000002 108.929 177.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.524 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 30.5 tt0 . . . . . 0 N--CA 1.446 -0.663 0 CA-C-N 114.671 -1.15 . . . . 1.45 110.577 -178.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.624 HG22 ' H ' ' A' ' 42' ' ' GLU . 0.5 OUTLIER . . . . . 0 CA--C 1.537 0.445 0 CA-C-O 120.366 0.127 . . . . 1.45 110.757 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.624 ' H ' HG22 ' A' ' 41' ' ' THR . 0.0 OUTLIER -91.85 -35.36 14.12 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 121.717 0.77 . . . . 2.02 109.486 172.883 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.737 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 27.9 p -54.42 -36.96 64.55 Favored 'General case' 0 C--O 1.212 -0.886 0 CA-C-N 114.19 -1.368 . . . . 1.25 113.122 -171.044 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -42.6 -40.49 2.71 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.694 0.627 . . . . 1.9099999999999999 112.694 -171.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.529 ' HB1' HG23 ' A' ' 152' ' ' VAL . . . -87.51 -36.18 17.78 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 121.926 -0.484 . . . . 1.1799999999999999 111.543 178.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.665 HG13 ' HA ' ' A' ' 43' ' ' SER . 0.7 OUTLIER -72.63 -37.07 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.894 -0.139 . . . . 2.0099999999999998 111.18 -177.801 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.737 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.8 ptpt -67.15 -40.22 86.66 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.018 -0.734 . . . . 1.3799999999999999 109.018 175.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.591 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 5.9 mm100 -63.28 -34.62 78.07 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.317 -0.856 . . . . 0.98999999999999999 110.953 176.118 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.472 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -72.67 -38.21 67.67 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.192 0.52 . . . . 1.1399999999999999 110.841 178.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 mp -69.96 -23.88 63.25 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.624 -0.716 . . . . 1.95 112.508 -174.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.588 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 9.3 ptp180 -84.92 -25.49 27.87 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.95 0.881 . . . . 2.5099999999999998 109.054 -175.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 10.7 mm-40 -78.05 -45.34 23.86 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.233 -1.349 . . . . 1.1000000000000001 110.202 176.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.03 -40.57 91.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.005 -0.543 . . . . 1.04 110.129 174.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.723 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.35 -41.0 98.27 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.778 -0.646 . . . . 0.69999999999999996 112.03 178.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.481 ' O ' HD21 ' A' ' 59' ' ' LEU . 19.6 t70 -55.09 -35.31 64.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.984 0.421 . . . . 1.04 110.767 -179.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.419 ' O ' HD22 ' A' ' 59' ' ' LEU . 29.4 mm-40 -73.3 -25.96 60.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.337 -0.847 . . . . 2.29 111.898 179.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.433 ' HE1' ' HA2' ' B' 1012 ' ' GLY . 66.2 t80 -83.51 -33.31 25.56 Favored 'General case' 0 C--N 1.316 -0.858 0 O-C-N 122.205 -0.309 . . . . 2.9300000000000002 111.703 177.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.723 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 39.6 mt-10 -66.34 -54.02 29.41 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.575 0.583 . . . . 1.3 112.575 -167.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.512 HD23 ' N ' ' A' ' 59' ' ' LEU . 2.1 pt? -53.75 -36.67 62.58 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.696 -0.684 . . . . 2.1899999999999999 110.775 -176.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 64.9 mtt180 -52.94 -55.65 21.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.54 -0.754 . . . . 3.1400000000000001 111.717 -178.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.617 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 47.9 p90 -90.72 -4.5 56.66 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 121.134 -0.227 . . . . 5.5899999999999999 111.119 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 53.3 ttp180 -54.34 -30.4 51.37 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 122.769 0.428 . . . . 4.9299999999999997 111.646 -177.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.518 ' HD2' ' H ' ' A' ' 63' ' ' ARG . 3.3 mpt_? -66.54 -35.28 79.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.987 0.422 . . . . 5.3499999999999996 110.641 179.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.517 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.35 -27.57 17.46 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.051 -0.522 . . . . 1.7 111.991 -179.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.57 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 51.6 t80 -41.67 -48.54 4.15 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.184 1.179 . . . . 3.52 114.184 -169.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.3 t -63.91 -44.25 93.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.932 0.396 . . . . 2.5899999999999999 110.682 -173.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -72.63 -32.57 66.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.97 -0.559 . . . . 2.7200000000000002 111.067 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.569 HD23 ' NE2' ' A' ' 71' ' ' GLN . 14.5 mt -58.87 -23.53 61.03 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 112.929 0.714 . . . . 2.25 112.929 -174.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.442 HG22 HG13 ' A' ' 74' ' ' ILE . 16.9 p -57.39 -26.27 60.82 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 118.33 0.514 . . . . 1.26 111.217 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -73.35 -24.81 60.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.712 -0.676 . . . . 1.8 109.938 177.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.569 ' NE2' HD23 ' A' ' 68' ' ' LEU . 16.3 mt-30 -87.41 -40.06 14.72 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.456 -0.793 . . . . 1.8899999999999999 110.163 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.55 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.3 mm? -65.56 -32.55 74.21 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.746 -0.465 . . . . 1.98 109.746 173.17 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 72.7 t60 66.33 44.33 2.48 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 107.673 -1.232 . . . . 3.54 107.673 -173.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.574 HG22 ' HE2' ' A' ' 119' ' ' MET . 26.3 mm -51.35 118.33 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 113.759 -1.564 . . . . 1.1499999999999999 111.541 -179.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.772 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.32 -171.82 0.3 Allowed Pre-proline 0 C--N 1.316 -0.877 0 N-CA-C 107.301 -1.37 . . . . 1.1200000000000001 107.301 -170.838 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.772 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 39.2 Cg_exo -29.07 165.36 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 125.07 3.847 . . . . 0.53000000000000003 115.576 165.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.43 -28.53 0.01 OUTLIER Glycine 0 N--CA 1.475 1.279 0 N-CA-C 117.826 1.891 . . . . 0.40999999999999998 117.826 -172.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.45 ' N ' ' O ' ' A' ' 76' ' ' PRO . 35.1 p -69.13 6.92 0.83 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 118.21 1.005 . . . . 1.22 112.476 -179.172 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.81 -11.84 60.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.244 0.545 . . . . 1.0700000000000001 110.192 174.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -76.52 -18.06 58.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.961 -0.563 . . . . 4.3099999999999996 109.673 175.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.42 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 32.8 mt-30 -84.27 -24.22 30.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.895 0.855 . . . . 1.03 109.329 173.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.5 m -71.48 -50.46 31.38 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.542 -1.208 . . . . 0.47999999999999998 109.23 170.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -67.85 -18.69 64.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.252 -0.886 . . . . 1.4399999999999999 110.167 175.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.576 ' HA ' HG13 ' A' ' 87' ' ' VAL . 42.7 tt0 -59.73 -52.17 66.63 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-O 121.605 0.717 . . . . 0.80000000000000004 110.026 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.471 ' H ' ' HG2' ' A' ' 85' ' ' GLN . 57.4 mm-40 -47.47 -35.07 8.12 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.707 -1.588 . . . . 1.99 110.781 177.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.84 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -86.36 -49.76 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 CA-C-N 114.519 -1.219 . . . . 1.8999999999999999 111.054 -175.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.576 HG13 ' HA ' ' A' ' 84' ' ' GLU . 9.7 p -62.81 -22.72 31.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.979 0.895 . . . . 1.4299999999999999 109.361 -178.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.603 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 2.6 m-80 -71.08 -52.21 20.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.306 -1.315 . . . . 0.91000000000000003 111.146 174.225 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 1.027 ' HB2' ' HB3' ' B' 1009 ' ' ALA . 0.0 OUTLIER -67.51 -38.22 83.98 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-O 121.754 0.787 . . . . 2.8700000000000001 109.346 -177.039 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.45 ' HG ' ' OE2' ' A' ' 89' ' ' GLU . 18.2 mt -63.01 -24.87 68.12 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 113.867 -1.515 . . . . 1.9199999999999999 111.46 -178.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.667 ' HA ' HG23 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -110.27 -40.61 4.63 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 112.588 0.588 . . . . 2.9700000000000002 112.588 -170.558 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.603 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER -67.8 -29.83 69.11 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.316 0.579 . . . . 5.6699999999999999 110.784 -171.318 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.516 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 1.2 m-20 -98.88 17.22 20.05 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.353 -0.84 . . . . 3.1200000000000001 112.972 -172.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.576 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 126.38 71.75 0.19 Allowed Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 117.18 -2.438 . . . . 2.3100000000000001 115.758 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.667 HG23 ' HA ' ' A' ' 91' ' ' PHE . 57.8 t -71.42 102.73 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-N 118.977 1.388 . . . . 1.6799999999999999 110.698 177.022 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -112.16 -172.53 2.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.848 -1.069 . . . . 2.1200000000000001 110.143 -178.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.691 ' HD1' ' HB3' ' A' ' 145' ' ' ASN . 74.0 t90 -51.46 -49.43 61.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.408 -0.814 . . . . 4.1200000000000001 111.799 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -86.36 -14.42 66.22 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 120.775 -0.726 . . . . 0.80000000000000004 114.04 -174.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.576 ' HG3' ' O ' ' A' ' 94' ' ' GLY . 24.9 mmt180 -64.17 -45.01 90.27 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 117.459 0.63 . . . . 4.9100000000000001 111.398 -176.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.629 ' HA ' ' CD1' ' A' ' 103' ' ' PHE . 66.7 mt -60.0 -30.83 46.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.51 -0.768 . . . . 1.1100000000000001 111.542 -174.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 36.3 t -56.58 -54.63 26.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.653 -0.703 . . . . 2.0299999999999998 110.384 171.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.78 -40.99 63.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.304 -0.862 . . . . 1.0600000000000001 111.875 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.629 ' CD1' ' HA ' ' A' ' 100' ' ' ILE . 68.1 m-85 -50.42 -56.69 10.33 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.311 0.577 . . . . 1.8400000000000001 110.56 177.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.822 ' HA ' ' HE2' ' A' ' 130' ' ' MET . 17.7 m-85 -75.57 -27.4 58.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.546 -0.752 . . . . 4.21 111.178 -174.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.737 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 47.2 m -62.81 -46.36 88.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.863 0.364 . . . . 1.55 110.452 178.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.546 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 56.5 t80 -80.84 -32.36 35.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.232 -0.44 . . . . 3.6400000000000001 110.483 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.766 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.93 -40.42 95.37 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.64 -0.791 . . . . 0.32000000000000001 111.9 176.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 1.055 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.51 -31.0 75.59 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 111.152 -0.779 . . . . 0.23999999999999999 111.152 174.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.57 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -72.42 -32.66 66.52 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 110.02 -0.363 . . . . 1.05 110.02 176.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.421 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.2 OUTLIER -65.66 -36.23 83.06 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.833 0.825 . . . . 1.78 110.123 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.697 ' SG ' HG12 ' A' ' 123' ' ' VAL . 35.8 t -50.55 -48.01 57.51 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 114.468 -1.242 . . . . 0.90000000000000002 109.233 172.06 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.716 HG12 ' HE2' ' A' ' 20' ' ' LYS . 92.3 t -71.04 -32.64 48.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.599 -0.728 . . . . 1.2 110.879 177.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.439 ' HB3' HG23 ' A' ' 74' ' ' ILE . 40.0 mt-10 -57.27 -34.46 68.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.26 0.552 . . . . 2.5099999999999998 110.223 174.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.445 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 16.6 m -77.21 -35.06 55.97 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 115.682 -0.69 . . . . 0.28000000000000003 109.312 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.66 HG22 ' O ' ' A' ' 111' ' ' CYS . 86.9 t -69.04 -35.21 67.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 121.91 0.862 . . . . 1.8300000000000001 109.344 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -53.49 -49.28 67.84 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 113.547 -1.66 . . . . 0.59999999999999998 111.374 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.426 ' CG ' ' HE1' ' A' ' 119' ' ' MET . 34.3 mmtt -88.15 13.09 12.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.856 -0.611 . . . . 2.1600000000000001 110.387 -179.069 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 61.09 52.34 4.06 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.723 0.773 . . . . 1.8799999999999999 110.335 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.574 ' HE2' HG22 ' A' ' 74' ' ' ILE . 28.7 mtm -130.96 44.37 2.97 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 107.781 -1.192 . . . . 1.0800000000000001 107.781 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.633 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 15.1 mp0 -60.02 -6.66 1.43 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.746 -1.116 . . . . 1.1499999999999999 113.465 -172.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.587 HG21 HD23 ' A' ' 122' ' ' LEU . 31.4 m -65.96 -26.63 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 121.943 -0.473 . . . . 1.1899999999999999 111.553 175.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.711 HD11 ' HD2' ' A' ' 125' ' ' ARG . 3.1 mm? -71.85 -27.13 62.68 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 110.373 -0.232 . . . . 1.0600000000000001 110.373 -179.11 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.697 HG12 ' SG ' ' A' ' 111' ' ' CYS . 41.0 t -39.07 -55.56 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 O-C-N 124.33 1.019 . . . . 1.0 112.736 177.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.533 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 5.7 t -77.9 -30.54 50.71 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.642 -0.423 . . . . 1.6599999999999999 110.773 -177.501 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.711 ' HD2' HD11 ' A' ' 122' ' ' LEU . 88.0 mtt180 -66.57 -48.78 68.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.204 -0.453 . . . . 3.2999999999999998 110.997 -176.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.487 HD11 ' HA ' ' A' ' 111' ' ' CYS . 75.3 mt -53.66 -49.9 53.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.731 -0.668 . . . . 1.0600000000000001 110.874 178.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.581 ' HB1' HD22 ' A' ' 13' ' ' LEU . . . -56.53 -36.99 69.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.996 -0.547 . . . . 1.1000000000000001 112.046 -178.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.13 -57.85 10.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.459 0.647 . . . . 1.1200000000000001 110.91 178.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -65.5 -37.32 86.45 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.695 -1.139 . . . . 4.7699999999999996 111.02 -176.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.822 ' HE2' ' HA ' ' A' ' 104' ' ' PHE . 0.4 OUTLIER -61.9 -48.63 79.58 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.034 0.445 . . . . 1.0900000000000001 111.091 179.712 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.59 ' HB1' ' HA ' ' A' ' 6' ' ' ARG . . . -67.75 -37.81 82.63 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 1.05 111.227 -178.059 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 96.9 m -65.57 -45.62 82.59 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.794 -0.363 . . . . 1.1299999999999999 110.982 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.404 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 49.1 t80 -56.47 -43.36 79.53 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.554 -0.536 . . . . 3.3500000000000001 109.554 177.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.977 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.4 OUTLIER -54.9 -61.33 2.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.764 -0.653 . . . . 1.5900000000000001 109.786 170.992 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -43.9 -56.17 4.08 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.3 -0.864 . . . . 0.46000000000000002 112.808 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -76.94 -51.37 11.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.117 0.484 . . . . 0.58999999999999997 111.925 -174.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 0.4 OUTLIER -92.0 -51.56 5.14 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.982 0.734 . . . . 2.3399999999999999 112.982 -170.261 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.977 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -79.51 -42.18 25.77 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 114.492 1.293 . . . . 1.8999999999999999 114.492 -165.718 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.602 ' HA ' HD11 ' A' ' 142' ' ' ILE . 29.2 tt0 -44.09 -48.99 23.21 Favored Pre-proline 0 N--CA 1.472 0.643 0 N-CA-C 112.906 0.706 . . . . 0.75 112.906 -174.137 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.567 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.0 Cg_exo -52.91 -46.77 31.46 Favored 'Trans proline' 0 C--N 1.356 0.957 0 C-N-CA 121.949 1.766 . . . . 0.87 111.952 175.321 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -48.84 78.71 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.801 -0.636 . . . . 1.4299999999999999 110.921 178.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.602 HD11 ' HA ' ' A' ' 139' ' ' GLU . 1.7 mp -49.73 -47.75 21.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.142 0.496 . . . . 1.1299999999999999 110.694 177.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 70.8 mm-40 -64.44 -29.59 70.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.538 -0.756 . . . . 0.57999999999999996 111.991 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.567 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 19.1 mm-40 -62.15 -24.13 66.99 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.784 0.802 . . . . 0.78000000000000003 110.006 176.007 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.691 ' HB3' ' HD1' ' A' ' 97' ' ' TRP . 23.0 m-80 -104.89 10.98 34.15 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.5 -1.227 . . . . 0.93000000000000005 109.715 -174.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 106.56 -12.54 42.89 Favored Glycine 0 N--CA 1.439 -1.164 0 CA-C-N 114.618 -1.174 . . . . 0.56000000000000005 113.116 174.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . 0.507 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 102.29 174.45 27.44 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.366 -0.921 . . . . 0.48999999999999999 112.098 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.4 ' HB3' ' CB ' ' A' ' 46' ' ' VAL . 56.0 m95 -63.97 -42.95 97.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.712 0.291 . . . . 4.5199999999999996 110.936 -178.239 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.466 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 26.9 t70 -53.8 -48.99 69.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.609 . . . . 1.96 110.882 177.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.546 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 67.9 m -58.9 -34.6 71.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.724 -0.671 . . . . 1.24 111.501 179.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -60.45 -45.27 94.29 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.698 -0.482 . . . . 3.7200000000000002 109.698 -179.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.529 HG23 ' HB1' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -72.62 -26.78 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.186 -0.461 . . . . 1.8600000000000001 110.314 178.0 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 18.5 mm-40 -60.98 -29.98 70.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.952 0.406 . . . . 1.6699999999999999 110.244 173.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.9 mt -94.1 -60.25 1.78 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.146 -0.479 . . . . 1.96 110.959 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . 0.666 ' HB2' ' HH2' ' A' ' 97' ' ' TRP . 3.2 t80 -121.05 26.37 9.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.338 0.59 . . . . 4.3899999999999997 110.468 -172.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.472 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -61.45 162.59 24.39 Favored Glycine 0 CA--C 1.499 -0.966 0 CA-C-N 115.716 -0.675 . . . . 1.1000000000000001 112.83 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . 0.543 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 26.4 t-20 . . . . . 0 C--N 1.309 -1.193 0 CA-C-N 114.12 -1.04 . . . . 1.29 110.754 178.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1005 ' ' GLY . . . . . 0.894 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.541 1.679 0 N-CA-C 114.188 0.435 . . . . 1.26 114.188 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 24.2 mmt180 -139.51 -41.58 0.45 Allowed 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 123.446 0.698 . . . . 3.4500000000000002 109.754 177.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1007 ' ' ALA . . . . . 0.521 ' O ' ' HD1' ' B' 1011 ' ' PHE . . . -59.9 -61.06 2.89 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 116.19 -0.459 . . . . 1.54 111.307 -177.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.798 ' H ' HD23 ' B' 1008 ' ' LEU . 1.0 OUTLIER -63.45 -39.8 95.43 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.49 -0.93 . . . . 1.8999999999999999 108.49 -179.19 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 1.027 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . . . -48.6 -49.97 34.6 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.521 -1.218 . . . . 1.45 110.58 172.213 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -78.18 -43.52 28.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.704 -1.135 . . . . 1.51 112.021 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1011 ' ' PHE . . . . . 0.521 ' HD1' ' O ' ' B' 1007 ' ' ALA . 46.3 m-85 -67.14 -26.73 66.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.223 0.535 . . . . 2.0699999999999998 110.42 178.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B 1012 ' ' GLY . . . . . 0.433 ' HA2' ' HE1' ' A' ' 57' ' ' PHE . . . -79.93 -6.77 88.98 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.45 -0.796 . . . . 0.80000000000000004 112.606 178.24 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 26.9 t70 -81.59 -2.95 51.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.483 0.658 . . . . 1.8999999999999999 109.941 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 20.2 m . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 115.883 -0.599 . . . . 1.4399999999999999 111.045 -178.88 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.631 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 76.4 mm-40 . . . . . 0 N--CA 1.462 0.139 0 N-CA-C 113.418 0.895 . . . . 2.7599999999999998 113.418 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.0 p -68.68 -18.31 64.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.109 0.48 . . . . 1.54 110.626 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.7 ' HB2' HD12 ' A' ' 134' ' ' LEU . 13.2 p30 -68.88 -20.76 64.27 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.029 -0.532 . . . . 1.78 111.06 176.304 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.631 ' HB2' ' O ' ' A' ' 3' ' ' GLN . 0.1 OUTLIER -51.96 -51.77 54.88 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.801 -0.636 . . . . 1.8999999999999999 110.31 175.95 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.625 ' CD ' ' HG ' ' A' ' 43' ' ' SER . 40.2 mt-10 -59.39 -48.2 82.56 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.867 -1.06 . . . . 0.68000000000000005 111.453 -176.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.648 HD22 ' HA ' ' A' ' 5' ' ' ASN . 1.4 mp -49.61 -34.55 18.28 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.439 -0.8 . . . . 1.8 111.087 176.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.557 ' CG2' ' HE1' ' A' ' 104' ' ' PHE . 72.6 t -79.39 -63.1 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.498 0.666 . . . . 1.0700000000000001 109.909 174.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 6' ' ' ARG . 93.6 t -50.66 -56.6 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.471 -1.241 . . . . 1.1299999999999999 112.766 -174.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.08 -33.08 68.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.709 0.29 . . . . 0.58999999999999997 110.469 -177.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.482 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 4.0 t80 -74.97 -46.2 37.03 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.287 -0.415 . . . . 2.02 110.735 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.922 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.9 mp -62.72 -40.79 98.3 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 120.103 -0.639 . . . . 1.0600000000000001 110.202 178.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.8 t -61.17 -40.7 94.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.172 0.51 . . . . 1.6000000000000001 110.065 176.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.412 ' HD2' ' HE3' ' A' ' 16' ' ' LYS . 81.3 t80 -63.15 -22.1 66.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.529 -0.759 . . . . 1.49 110.889 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.698 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.5 mmpt? -86.35 -43.75 12.62 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.516 0.674 . . . . 1.8400000000000001 110.203 -179.057 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.652 HD23 ' SG ' ' A' ' 111' ' ' CYS . 14.5 mt -66.69 -30.86 71.2 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 115.018 -0.992 . . . . 1.98 110.69 178.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.0 t -56.31 -43.51 79.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.541 -0.754 . . . . 1.3799999999999999 111.564 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -80.22 0.97 30.22 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.073 0.463 . . . . 1.51 112.103 -177.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.632 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 19.9 mmmt -108.28 -26.5 10.51 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 122.113 0.959 . . . . 2.6499999999999999 108.788 177.42 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 22.28 10.37 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 113.642 -1.617 . . . . 0.54000000000000004 111.47 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.737 ' HB3' ' HE2' ' A' ' 27' ' ' PHE . 89.9 m-85 -113.13 156.39 23.27 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.855 0.36 . . . . 1.1200000000000001 110.879 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.7 t -93.13 147.75 22.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.811 -0.631 . . . . 0.75 110.688 -179.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -73.33 -53.01 11.84 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.794 -0.639 . . . . 4.29 110.022 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -68.4 -28.89 67.49 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.186 0.439 . . . . 1.8600000000000001 112.186 -173.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -61.22 -29.63 69.94 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.672 -0.411 . . . . 1.52 111.363 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.737 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 13.5 m-85 -109.96 -15.34 14.09 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.3 -0.409 . . . . 1.53 111.338 -175.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.572 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 34.6 m -101.36 148.34 25.27 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 122.254 1.026 . . . . 2.04 112.632 -176.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.29 -2.84 11.07 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 113.113 -1.858 . . . . 2.3100000000000001 109.149 -177.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.604 HG22 ' H ' ' A' ' 31' ' ' GLU . 5.2 m -64.66 -75.76 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 114.636 -1.166 . . . . 1.4099999999999999 113.141 -169.132 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.604 ' H ' HG22 ' A' ' 30' ' ' VAL . 10.2 mm-40 -85.24 -2.28 57.87 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 122.075 0.94 . . . . 2.7400000000000002 108.861 -179.191 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 . . . . . 0 N--CA 1.441 -0.916 0 CA-C-N 114.188 -1.369 . . . . 1.45 110.425 174.91 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.801 HG21 ' H ' ' A' ' 42' ' ' GLU . 1.2 t . . . . . 0 CA--C 1.539 0.52 0 CA-C-O 120.693 0.282 . . . . 1.45 110.408 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.801 ' H ' HG21 ' A' ' 41' ' ' THR . 17.0 pt-20 -94.7 -23.51 17.54 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 122.999 1.38 . . . . 2.02 108.291 165.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.826 ' HB2' ' HE3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -63.04 -30.0 71.25 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 111.955 -2.384 . . . . 1.25 114.562 -169.725 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -46.19 -50.31 15.88 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 118.202 0.455 . . . . 1.9099999999999999 111.614 -173.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.567 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -74.93 -37.75 61.96 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.982 0.42 . . . . 1.1799999999999999 110.368 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.573 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 72.2 t -54.93 -65.21 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.37 -0.832 . . . . 2.0099999999999998 111.306 177.132 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.826 ' HE3' ' HB2' ' A' ' 43' ' ' SER . 19.3 ptpt -60.85 -34.51 74.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.865 -0.607 . . . . 1.3799999999999999 110.176 -176.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.605 HE21 ' ND2' ' A' ' 157' ' ' ASN . 6.8 mm100 -62.34 -36.36 81.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.64 -0.709 . . . . 0.98999999999999999 111.446 174.264 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.708 ' HB3' ' HA2' ' A' ' 156' ' ' GLY . . . -76.85 -35.25 57.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.497 0.665 . . . . 1.1399999999999999 110.066 175.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.564 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -54.85 -39.29 68.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.742 -1.117 . . . . 1.95 112.118 -179.771 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.506 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 13.0 ptp180 -79.59 -33.53 41.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.588 0.709 . . . . 2.5099999999999998 109.426 -174.381 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.672 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.0 mm-40 -67.95 -43.67 78.52 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.582 -1.19 . . . . 1.1000000000000001 110.218 178.082 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.57 -41.49 72.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.495 -0.775 . . . . 1.04 110.723 177.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.69 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.41 -44.62 97.36 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.825 -0.625 . . . . 0.69999999999999996 112.52 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.544 ' O ' HD23 ' A' ' 59' ' ' LEU . 28.8 t70 -54.33 -32.01 55.64 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.074 0.464 . . . . 1.04 111.294 -178.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -80.22 -25.6 39.54 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.379 -0.828 . . . . 2.29 112.488 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.616 ' CZ ' HD13 ' B' 1008 ' ' LEU . 91.7 t80 -82.54 -43.05 17.59 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.566 0.58 . . . . 2.9300000000000002 112.566 -179.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.69 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 30.4 mt-10 -58.33 -48.03 81.85 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.494 0.924 . . . . 1.3 113.494 -168.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.56 ' H ' ' CD2' ' A' ' 59' ' ' LEU . 1.0 OUTLIER -78.74 -7.81 58.13 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 123.717 0.807 . . . . 2.1899999999999999 112.409 -172.119 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 67.8 mtt-85 -45.01 -27.39 0.54 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 116.221 1.934 . . . . 3.1400000000000001 116.221 -161.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -90.38 -85.94 0.21 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 117.16 -1.816 . . . . 5.5899999999999999 109.894 174.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 56.6 mtm180 -109.18 -82.06 0.57 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 119.534 1.061 . . . . 4.9299999999999997 111.636 158.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.661 ' HB2' ' OD1' ' A' ' 67' ' ' ASP . 0.0 OUTLIER -103.07 11.65 36.93 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 113.844 -1.525 . . . . 5.3499999999999996 110.966 171.182 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.727 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -27.89 -54.99 0.1 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.378 1.622 . . . . 1.7 115.378 -150.371 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.437 ' CG ' ' HB3' ' A' ' 58' ' ' GLU . 19.6 p90 -47.82 -28.57 2.64 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 113.088 0.773 . . . . 3.52 113.088 -176.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.7 m -90.69 -36.66 14.22 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.202 0.445 . . . . 2.5899999999999999 112.202 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.661 ' OD1' ' HB2' ' A' ' 63' ' ' ARG . 4.5 m-20 -83.01 -23.21 33.37 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.799 0.296 . . . . 2.7200000000000002 111.799 -174.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 32.2 mt -61.47 -15.55 38.61 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.717 1.006 . . . . 2.25 113.717 -171.675 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.709 HG22 HG13 ' A' ' 74' ' ' ILE . 34.4 p -47.81 -29.27 3.06 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 123.314 0.384 . . . . 1.26 111.482 -177.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.8 t -53.28 -59.38 4.64 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.752 -0.658 . . . . 1.8 111.143 175.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.626 ' NE2' ' HA ' ' A' ' 68' ' ' LEU . 2.6 mp0 -54.51 -48.09 72.31 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.682 0.793 . . . . 1.8899999999999999 111.814 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.728 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.1 mp -81.25 -28.27 34.84 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.104 -0.953 . . . . 1.98 111.922 -168.081 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.5 t-80 62.8 64.38 0.89 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 122.155 0.978 . . . . 3.54 108.711 -177.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.709 HG13 HG22 ' A' ' 69' ' ' THR . 15.5 mm -65.03 118.54 7.54 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 113.963 -1.472 . . . . 1.1499999999999999 111.627 -174.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.736 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.26 -172.18 0.3 Allowed Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 107.47 -1.307 . . . . 1.1200000000000001 107.47 -171.247 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.736 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.3 Cg_exo -30.33 167.27 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 125.035 3.823 . . . . 0.53000000000000003 115.112 164.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.41 -25.68 0.0 OUTLIER Glycine 0 N--CA 1.475 1.239 0 N-CA-C 117.606 1.803 . . . . 0.40999999999999998 117.606 -174.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.473 ' N ' ' O ' ' A' ' 76' ' ' PRO . 34.6 p -72.05 6.76 1.95 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 118.119 0.959 . . . . 1.22 111.514 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.46 -16.71 61.81 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 109.304 -0.628 . . . . 1.0700000000000001 109.304 169.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.526 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 66.2 t80 -76.06 -15.12 60.17 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.574 -0.739 . . . . 4.3099999999999996 109.186 174.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.481 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 78.1 mt-30 -82.85 -28.79 29.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.766 0.793 . . . . 1.03 109.487 172.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.728 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.5 m -72.05 -53.14 13.8 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.58 -1.191 . . . . 0.47999999999999998 109.687 173.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.489 ' HE1' ' HB3' ' A' ' 106' ' ' PHE . 78.8 t80 -65.13 -18.94 65.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.559 -0.746 . . . . 1.4399999999999999 110.345 175.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.646 ' HA ' HG13 ' A' ' 87' ' ' VAL . 42.6 tt0 -60.59 -46.91 88.48 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 115.724 -0.671 . . . . 0.80000000000000004 110.426 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -49.1 -34.6 14.25 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.749 -1.114 . . . . 1.99 110.796 177.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.792 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.4 t -82.68 -54.72 8.84 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.025 -0.988 . . . . 1.8999999999999999 110.867 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.646 HG13 ' HA ' ' A' ' 84' ' ' GLU . 9.8 p -60.46 -25.31 33.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.537 0.684 . . . . 1.4299999999999999 109.648 -177.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.0 OUTLIER -62.08 -56.5 18.27 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.789 -1.096 . . . . 0.91000000000000003 110.742 171.607 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.896 ' HB2' ' HB1' ' B' 1009 ' ' ALA . 1.0 OUTLIER -62.05 -36.36 81.4 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 108.428 -0.953 . . . . 2.8700000000000001 108.428 -175.738 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.765 HD23 ' HE ' ' A' ' 99' ' ' ARG . 27.3 mt -70.9 -24.28 62.44 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 113.672 -1.603 . . . . 1.9199999999999999 112.345 -170.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.728 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 1.7 p90 -106.81 -23.56 12.35 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.052 0.453 . . . . 2.9700000000000002 111.516 -176.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.531 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 5.8 ptm180 -88.18 -41.56 12.9 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.889 0.376 . . . . 5.6699999999999999 111.71 -172.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -100.83 18.11 20.34 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.824 0.676 . . . . 3.1200000000000001 112.824 -165.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.503 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 129.03 69.38 0.12 Allowed Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 117.574 -2.25 . . . . 2.3100000000000001 114.846 178.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.728 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 61.1 t -70.7 103.94 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 118.421 1.111 . . . . 1.6799999999999999 110.416 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.649 HD21 ' N ' ' A' ' 96' ' ' ASN . 0.7 OUTLIER -110.93 -175.06 2.62 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.973 -1.012 . . . . 2.1200000000000001 108.427 176.562 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.529 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 21.8 m-90 -54.72 -47.33 73.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.008 0.432 . . . . 4.1200000000000001 110.27 178.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.13 -30.47 71.9 Favored Glycine 0 CA--C 1.519 0.317 0 CA-C-N 115.738 -0.664 . . . . 0.80000000000000004 113.772 -176.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.765 ' HE ' HD23 ' A' ' 90' ' ' LEU . 9.9 mmm-85 -62.68 -35.61 80.23 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.4 0.619 . . . . 4.9100000000000001 110.798 -178.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.497 ' O ' ' HB3' ' A' ' 103' ' ' PHE . 72.5 mt -75.01 -41.25 45.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 CA-C-N 115.53 -0.759 . . . . 1.1100000000000001 110.812 -177.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -59.53 -35.93 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 109.671 -0.492 . . . . 2.0299999999999998 109.671 174.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.16 87.27 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.786 -0.643 . . . . 1.0600000000000001 110.632 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.55 ' HZ ' ' HA ' ' A' ' 130' ' ' MET . 67.4 t80 -51.9 -42.87 63.06 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.13 -0.941 . . . . 1.8400000000000001 110.12 173.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.883 ' HA ' ' HE1' ' A' ' 130' ' ' MET . 89.0 m-85 -75.41 -39.7 58.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.076 -0.511 . . . . 4.21 111.367 178.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.482 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 19.3 m -56.16 -50.13 72.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.063 0.459 . . . . 1.55 110.365 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.512 ' HZ ' HD12 ' A' ' 72' ' ' LEU . 1.2 t80 -79.07 -35.42 42.47 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.95 -0.568 . . . . 3.6400000000000001 110.569 -178.226 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.655 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.06 -43.46 95.7 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.75 -0.738 . . . . 0.32000000000000001 111.999 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.922 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.64 -33.02 79.7 Favored Glycine 0 N--CA 1.443 -0.89 0 N-CA-C 110.875 -0.89 . . . . 0.23999999999999999 110.875 175.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.77 -34.25 73.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.47 -0.365 . . . . 1.05 110.606 176.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.526 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.47 -39.57 94.81 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 108.257 -1.016 . . . . 1.78 108.257 -178.806 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.671 ' SG ' HG13 ' A' ' 123' ' ' VAL . 43.9 t -52.78 -52.6 56.04 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 113.899 -1.5 . . . . 0.90000000000000002 109.913 173.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.579 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 92.6 t -68.07 -38.43 79.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.97 -0.559 . . . . 1.2 111.686 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.52 ' HB3' HG23 ' A' ' 74' ' ' ILE . 35.7 mt-10 -58.11 -28.17 64.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.158 0.504 . . . . 2.5099999999999998 110.027 176.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.44 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 50.8 m -79.01 -41.28 29.29 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.859 -0.61 . . . . 0.28000000000000003 109.503 176.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.639 HG22 ' O ' ' A' ' 111' ' ' CYS . 88.0 t -64.04 -33.92 65.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 122.066 0.936 . . . . 1.8300000000000001 109.455 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . 0.442 ' OD1' ' HD3' ' A' ' 117' ' ' LYS . 15.2 t70 -51.54 -50.39 60.14 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 113.401 -1.727 . . . . 0.59999999999999998 111.278 178.186 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.447 ' CG ' ' HE1' ' A' ' 119' ' ' MET . 12.1 mmtp -88.33 13.3 11.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.061 -0.518 . . . . 2.1600000000000001 110.231 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 63.2 42.84 6.76 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-O 121.657 0.742 . . . . 1.8799999999999999 110.749 -177.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.45 ' HE3' ' HB2' ' A' ' 119' ' ' MET . 29.7 mtm -116.16 46.29 1.6 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.069 -1.086 . . . . 1.0800000000000001 108.069 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.448 ' HA ' HG23 ' A' ' 123' ' ' VAL . 3.7 mt-30 -61.61 -7.45 3.35 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.468 -1.242 . . . . 1.1499999999999999 112.847 -175.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.602 HG21 HD21 ' A' ' 122' ' ' LEU . 27.8 m -65.82 -27.31 40.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 122.244 -0.285 . . . . 1.1899999999999999 111.067 173.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.685 HD11 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -70.8 -29.45 65.64 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 116.569 -0.287 . . . . 1.0600000000000001 110.321 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.671 HG13 ' SG ' ' A' ' 111' ' ' CYS . 76.3 t -43.05 -55.5 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 O-C-N 124.001 0.813 . . . . 1.0 111.909 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.572 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 2.9 t -70.32 -35.0 73.36 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.779 0.323 . . . . 1.6599999999999999 110.914 -178.103 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.685 ' HD2' HD11 ' A' ' 122' ' ' LEU . 94.7 mtt180 -63.47 -56.02 19.46 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 121.13 0.491 . . . . 3.2999999999999998 110.158 -178.243 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.526 HD13 ' HB3' ' A' ' 110' ' ' LEU . 68.8 mt -51.82 -53.72 16.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.139 -0.937 . . . . 1.0600000000000001 110.964 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.547 ' HB1' HD21 ' A' ' 13' ' ' LEU . . . -54.84 -34.45 62.87 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 111.711 0.263 . . . . 1.1000000000000001 111.711 -178.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.13 -58.05 8.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.48 0.657 . . . . 1.1200000000000001 110.892 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -68.76 -26.1 65.05 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.026 -0.988 . . . . 4.7699999999999996 111.224 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.883 ' HE1' ' HA ' ' A' ' 104' ' ' PHE . 21.5 mmm -62.87 -60.57 3.29 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.168 -0.469 . . . . 1.0900000000000001 110.683 176.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.556 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -62.37 -35.11 78.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.173 -0.467 . . . . 1.05 110.972 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 89.6 m -63.71 -47.47 80.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.336 -0.393 . . . . 1.1299999999999999 111.261 176.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -60.35 -37.35 80.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.96 -0.385 . . . . 3.3500000000000001 109.96 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.806 HD13 ' HZ ' ' A' ' 104' ' ' PHE . 5.9 tt -64.1 -50.2 69.21 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.752 -0.832 . . . . 1.5900000000000001 108.752 173.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -47.95 -57.37 5.82 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.878 -0.601 . . . . 0.46000000000000002 112.028 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -80.85 -48.85 11.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.398 0.518 . . . . 0.58999999999999997 112.398 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -90.77 -47.81 7.41 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.127 0.788 . . . . 2.3399999999999999 113.127 -169.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.439 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 58.2 mt -91.04 -32.89 15.73 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.011 0.745 . . . . 1.8999999999999999 113.011 -165.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.62 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 29.6 tt0 -49.67 -50.23 68.07 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 111.915 0.339 . . . . 0.75 111.915 -174.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.593 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 13.3 Cg_endo -57.83 -49.7 12.36 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.902 1.735 . . . . 0.87 111.913 175.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . 0.419 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -56.02 -47.41 77.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.721 -0.672 . . . . 1.4299999999999999 110.471 179.282 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.613 HD13 ' HA ' ' A' ' 139' ' ' GLU . 15.0 mt -50.15 -50.86 19.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.609 -0.723 . . . . 1.1299999999999999 111.27 175.2 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.62 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 80.8 mm-40 -58.84 -34.09 71.18 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.572 -0.74 . . . . 0.57999999999999996 111.252 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.593 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 6.1 mm-40 -66.57 -21.71 66.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.381 0.61 . . . . 0.78000000000000003 110.773 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.628 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -102.42 -4.95 24.68 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.504 -0.771 . . . . 0.93000000000000005 109.787 -174.743 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 123.13 -31.92 4.54 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.479 -0.782 . . . . 0.56000000000000005 112.851 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . 0.484 ' HA2' HG21 ' A' ' 142' ' ' ILE . . . 123.45 -175.48 16.71 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.731 -0.747 . . . . 0.48999999999999999 112.046 -178.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.542 ' NE1' HD12 ' A' ' 142' ' ' ILE . 11.2 m-90 -78.68 -39.69 36.01 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.839 0.352 . . . . 4.5199999999999996 110.38 -178.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -61.98 -42.21 98.88 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.109 -0.496 . . . . 1.96 110.07 179.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.594 ' O ' HD12 ' A' ' 154' ' ' LEU . 85.0 m -57.4 -35.5 70.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.768 -0.651 . . . . 1.24 110.869 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.529 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 78.7 t80 -60.66 -39.84 89.85 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 120.43 -0.508 . . . . 3.7200000000000002 110.102 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.571 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -78.18 -26.19 14.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.158 0.504 . . . . 1.8600000000000001 110.331 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -59.33 -42.32 91.19 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.399 0.619 . . . . 1.6699999999999999 109.695 171.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.594 HD12 ' O ' ' A' ' 150' ' ' THR . 8.1 mp -80.37 -60.04 2.47 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.093 -0.958 . . . . 1.96 112.873 177.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -119.86 27.04 8.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.272 0.558 . . . . 4.3899999999999997 110.203 -168.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.708 ' HA2' ' HB3' ' A' ' 49' ' ' ALA . . . -57.17 161.69 8.22 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-O 122.022 0.79 . . . . 1.1000000000000001 114.665 -178.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . 0.672 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 28.1 t-20 . . . . . 0 C--N 1.316 -0.865 0 CA-C-N 113.202 -1.499 . . . . 1.29 111.601 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.013 0 CA-C-O 120.926 0.181 . . . . 1.26 113.014 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B 1006 ' ' ARG . . . . . 0.411 HH11 ' HD2' ' B' 1006 ' ' ARG . 3.7 mpt_? -90.59 -41.74 11.18 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.776 0.322 . . . . 3.4500000000000002 111.241 175.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -70.32 -66.13 0.64 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.466 0.543 . . . . 1.54 112.466 -171.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.616 HD13 ' CZ ' ' A' ' 57' ' ' PHE . 3.3 mm? -57.5 -40.04 77.83 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.312 0.577 . . . . 1.8999999999999999 110.18 -173.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 0.896 ' HB1' ' HB2' ' A' ' 89' ' ' GLU . . . -53.92 -40.19 66.48 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.642 -1.163 . . . . 1.45 110.726 176.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -80.25 -41.22 25.48 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.827 -1.078 . . . . 1.51 111.143 -177.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -70.52 -33.63 71.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.702 -0.681 . . . . 2.0699999999999998 111.581 -178.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -70.84 -24.42 77.05 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.188 -0.53 . . . . 0.80000000000000004 113.367 -175.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 38.5 t70 -74.19 -4.24 34.72 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.206 0.527 . . . . 1.8999999999999999 111.061 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 22.4 m . . . . . 0 C--N 1.328 -0.341 0 CA-C-O 121.011 0.434 . . . . 1.4399999999999999 110.202 179.842 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.637 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 26.8 mp0 . . . . . 0 C--O 1.224 -0.266 0 CA-C-O 120.623 0.249 . . . . 2.7599999999999998 110.985 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.57 ' HB3' ' HB3' ' A' ' 43' ' ' SER . 19.3 m -72.45 -23.66 61.09 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 111.683 0.253 . . . . 1.54 111.683 -174.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.928 ' HA ' HD23 ' A' ' 8' ' ' LEU . 6.3 p30 -65.16 -22.43 66.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.763 0.316 . . . . 1.78 110.434 175.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.637 ' HB2' ' O ' ' A' ' 3' ' ' GLN . 0.6 OUTLIER -58.55 -53.15 61.59 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 115.949 -0.569 . . . . 1.8999999999999999 110.133 173.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.539 ' CD ' ' HG ' ' A' ' 43' ' ' SER . 36.9 mt-10 -56.23 -49.11 75.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.184 -0.916 . . . . 0.68000000000000005 110.733 -178.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.928 HD23 ' HA ' ' A' ' 5' ' ' ASN . 0.6 OUTLIER -47.49 -44.19 25.2 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.499 -0.773 . . . . 1.8 111.056 176.385 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.407 HG13 HD11 ' A' ' 13' ' ' LEU . 72.9 t -70.79 -64.05 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.296 0.57 . . . . 1.0700000000000001 110.548 175.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 6' ' ' ARG . 48.8 t -51.83 -48.49 38.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 114.906 -1.043 . . . . 1.1299999999999999 112.676 -174.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -56.03 -38.06 70.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.291 -0.413 . . . . 0.58999999999999997 110.679 -178.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.639 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 47.6 t80 -74.33 -45.01 50.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.136 -0.483 . . . . 2.02 110.964 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.701 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.8 mp -57.67 -44.06 85.49 Favored 'General case' 0 C--N 1.338 0.083 0 C-N-CA 120.386 -0.525 . . . . 1.0600000000000001 109.846 178.514 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 m -58.48 -40.47 82.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.47 0.652 . . . . 1.6000000000000001 110.675 177.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -73.67 -17.99 61.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.299 -0.864 . . . . 1.49 111.215 -174.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.637 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.0 mmpt? -88.52 -47.75 8.09 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-O 121.5 0.667 . . . . 1.8400000000000001 110.32 -178.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.593 HD21 ' SG ' ' A' ' 111' ' ' CYS . 13.4 mt -57.41 -30.8 65.25 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 115.258 -0.883 . . . . 1.98 111.335 177.492 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.5 t -57.24 -47.78 80.49 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.112 -0.495 . . . . 1.3799999999999999 111.409 177.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -74.14 1.4 11.29 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.931 0.396 . . . . 1.51 111.854 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.661 ' HE2' HG11 ' A' ' 112' ' ' VAL . 15.3 mmmt -110.49 -26.74 9.34 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.953 0.883 . . . . 2.6499999999999999 109.172 178.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.72 26.3 7.23 Favored Glycine 0 N--CA 1.443 -0.833 0 CA-C-N 114.014 -1.448 . . . . 0.54000000000000004 111.921 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -122.59 167.19 13.7 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.851 0.358 . . . . 1.1200000000000001 110.831 174.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.9 t -110.55 151.19 27.9 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.897 -0.592 . . . . 0.75 110.003 177.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -72.67 -51.1 20.85 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.08 -0.509 . . . . 4.29 109.759 172.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.1 p -61.72 -40.61 95.69 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.68 -0.691 . . . . 1.8600000000000001 111.596 -171.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -55.74 -31.0 62.15 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.103 0.478 . . . . 1.52 111.33 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -114.14 16.05 18.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.937 -0.574 . . . . 1.53 111.125 -176.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.602 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 59.8 p -100.97 -179.68 4.12 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.739 0.781 . . . . 2.04 112.359 -175.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.588 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 6.9 t70 -163.91 -24.44 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 113.934 -1.485 . . . . 2.3100000000000001 108.142 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.635 HG21 ' H ' ' A' ' 31' ' ' GLU . 9.9 m -57.91 -72.88 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 113.884 -1.507 . . . . 1.4099999999999999 112.874 -177.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.635 ' H ' HG21 ' A' ' 30' ' ' VAL . 14.5 mm-40 -86.59 -0.05 55.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.543 -0.91 . . . . 2.7400000000000002 108.543 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.588 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.1 tt0 . . . . . 0 N--CA 1.445 -0.724 0 CA-C-N 114.663 -1.153 . . . . 1.45 110.182 178.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.83 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.5 t . . . . . 0 CA--C 1.539 0.545 0 CA-C-O 120.496 0.189 . . . . 1.45 110.586 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.83 ' H ' HG23 ' A' ' 41' ' ' THR . 12.8 pt-20 -93.1 -29.99 15.49 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 122.545 1.164 . . . . 2.02 108.692 168.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.632 ' HA ' HG12 ' A' ' 46' ' ' VAL . 3.7 p -60.06 -27.13 66.71 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 112.717 -2.038 . . . . 1.25 113.599 -170.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -46.17 -54.15 9.2 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 111.8 0.296 . . . . 1.9099999999999999 111.8 -176.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.99 -41.76 61.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.555 0.217 . . . . 1.1799999999999999 111.521 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.632 HG12 ' HA ' ' A' ' 43' ' ' SER . 0.5 OUTLIER -70.19 -37.15 70.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.896 -0.322 . . . . 2.0099999999999998 111.29 -174.787 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.56 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 8.4 ptpt -68.12 -36.38 79.63 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.4 -0.963 . . . . 1.3799999999999999 108.4 176.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.473 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 3.8 mm100 -63.79 -38.84 92.61 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.195 -0.911 . . . . 0.98999999999999999 110.619 178.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.622 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -74.0 -41.38 61.97 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.183 0.516 . . . . 1.1399999999999999 110.632 176.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.466 HD23 ' HA ' ' A' ' 50' ' ' LEU . 0.1 OUTLIER -54.6 -43.53 72.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.092 -0.958 . . . . 1.95 111.687 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.56 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 7.9 ptp180 -74.58 -26.16 59.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.179 0.514 . . . . 2.5099999999999998 110.026 -170.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 5.3 mm-40 -74.17 -51.46 15.44 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.898 -1.046 . . . . 1.1000000000000001 110.077 178.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.32 -42.13 99.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.517 -0.765 . . . . 1.04 110.19 177.075 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.596 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -64.74 -38.29 95.43 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.584 -0.735 . . . . 0.69999999999999996 111.95 176.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.421 ' HA ' ' OE2' ' A' ' 58' ' ' GLU . 14.7 t70 -57.59 -54.14 50.2 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 122.337 0.255 . . . . 1.04 110.496 177.039 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.52 ' HA ' HD12 ' A' ' 59' ' ' LEU . 48.0 mt-10 -56.99 -27.72 61.72 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 123.847 0.717 . . . . 2.29 111.569 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -72.98 -30.67 63.98 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.929 -0.578 . . . . 2.9300000000000002 110.921 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.596 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 41.0 mt-10 -70.47 -70.27 0.31 Allowed 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 112.18 0.437 . . . . 1.3 112.18 -173.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.672 HD21 ' N ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -55.6 -34.52 64.93 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.083 0.468 . . . . 2.1899999999999999 111.457 -174.661 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.672 ' N ' HD21 ' A' ' 59' ' ' LEU . 7.3 ttm180 -53.04 -66.39 0.39 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.337 -0.847 . . . . 3.1400000000000001 111.676 176.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.451 ' OH ' ' O ' ' B' 1011 ' ' PHE . 40.3 m-85 -94.22 -0.23 55.27 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.161 0.8 . . . . 5.5899999999999999 113.161 -172.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.473 ' HA ' ' CD2' ' A' ' 65' ' ' PHE . 3.0 tmt_? -43.69 -38.41 3.11 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.38 0.672 . . . . 4.9299999999999997 112.272 -176.272 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 67.1 mtt180 -46.39 -50.36 16.68 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.111 0.481 . . . . 5.3499999999999996 110.551 176.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.457 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -71.91 -47.76 50.34 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 115.609 -0.723 . . . . 1.7 110.854 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.473 ' CD2' ' HA ' ' A' ' 62' ' ' ARG . 17.9 m-85 -45.9 -48.65 16.12 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.905 0.706 . . . . 3.52 112.905 -172.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' SER . . . . . 0.403 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 27.8 t -62.46 -38.28 89.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.111 0.481 . . . . 2.5899999999999999 110.894 -177.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -81.21 -31.58 33.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.183 0.516 . . . . 2.7200000000000002 110.479 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.457 HD13 ' O ' ' A' ' 64' ' ' ALA . 1.8 mp -60.64 -17.66 48.65 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.309 -0.859 . . . . 2.25 112.296 -177.225 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.727 HG22 HG13 ' A' ' 74' ' ' ILE . 3.4 p -55.83 -25.43 41.79 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.165 0.439 . . . . 1.26 110.926 177.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.5 t -74.35 -37.24 63.56 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.266 0.555 . . . . 1.8 109.535 175.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -72.36 -40.89 67.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.321 -0.854 . . . . 1.8899999999999999 110.37 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.457 HD21 ' O ' ' A' ' 68' ' ' LEU . 3.1 mm? -68.25 -34.31 75.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.641 -0.503 . . . . 1.98 109.641 170.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.419 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 85.9 t60 71.11 0.76 3.54 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.586 -0.734 . . . . 3.54 109.844 -171.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.727 HG13 HG22 ' A' ' 69' ' ' THR . 31.6 mm 20.12 -85.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 126.0 1.72 . . . . 1.1499999999999999 114.256 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.89 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER 23.14 -160.87 0.0 OUTLIER Pre-proline 0 CA--C 1.588 2.423 0 C-N-CA 125.033 1.333 . . . . 1.1200000000000001 113.513 -173.927 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.89 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 76.2 Cg_exo -28.13 165.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 125.267 3.978 . . . . 0.53000000000000003 117.281 169.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -34.68 -20.9 0.01 OUTLIER Glycine 0 C--N 1.347 1.153 0 N-CA-C 117.627 1.811 . . . . 0.40999999999999998 117.627 -173.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.438 ' N ' ' O ' ' A' ' 76' ' ' PRO . 38.2 p -66.69 0.91 2.04 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 117.97 0.885 . . . . 1.22 111.481 178.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.476 ' HA ' ' OG ' ' A' ' 82' ' ' SER . . . -67.91 -14.72 63.19 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.987 -0.552 . . . . 1.0700000000000001 110.272 172.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -78.31 -21.01 50.29 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.367 -0.605 . . . . 4.3099999999999996 109.367 176.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.53 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 41.9 mt-30 -81.86 -25.87 34.71 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.006 0.908 . . . . 1.03 109.387 172.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.476 ' OG ' ' HA ' ' A' ' 79' ' ' ALA . 2.3 m -72.23 -54.22 10.26 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.344 -1.298 . . . . 0.47999999999999998 109.743 173.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.466 ' HE2' ' CE1' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -62.41 -19.5 63.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.887 -1.051 . . . . 1.4399999999999999 110.213 176.21 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.586 ' HA ' HG12 ' A' ' 87' ' ' VAL . 37.2 tt0 -63.39 -51.6 65.17 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.043 -0.981 . . . . 0.80000000000000004 111.027 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -50.03 -33.05 16.94 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.076 -0.965 . . . . 1.99 110.82 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.665 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -83.13 -51.65 14.19 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.04 0 CA-C-N 114.605 -1.179 . . . . 1.8999999999999999 110.725 -177.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.586 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.8 p -61.64 -22.38 28.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.888 0.851 . . . . 1.4299999999999999 109.378 -178.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.576 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.7 m-80 -68.07 -51.72 43.35 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 114.142 -1.39 . . . . 0.91000000000000003 110.912 173.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.958 ' HB2' ' HB3' ' B' 1009 ' ' ALA . 0.9 OUTLIER -65.45 -37.31 86.5 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 121.763 0.792 . . . . 2.8700000000000001 108.872 -178.932 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.61 ' HG ' ' CD ' ' A' ' 89' ' ' GLU . 21.1 mt -67.17 -19.22 65.55 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 113.907 -1.497 . . . . 1.9199999999999999 112.591 -167.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.721 ' HA ' HG21 ' A' ' 95' ' ' VAL . 2.7 p90 -109.94 -19.7 13.01 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.78 -0.368 . . . . 2.9700000000000002 111.878 -174.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.576 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.0 OUTLIER -100.98 -22.53 14.74 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.255 -0.578 . . . . 5.6699999999999999 111.253 -177.984 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -96.15 21.19 9.18 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.822 -0.626 . . . . 3.1200000000000001 111.345 -169.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 112.82 67.62 0.51 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 118.291 -1.909 . . . . 2.3100000000000001 114.059 175.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.721 HG21 ' HA ' ' A' ' 91' ' ' PHE . 38.8 t -70.33 95.63 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.465 0 CA-C-O 122.67 1.224 . . . . 1.6799999999999999 110.928 -177.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.641 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 0.2 OUTLIER -110.2 179.21 4.16 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 113.095 -1.866 . . . . 2.1200000000000001 107.252 167.618 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.6 ' HB3' ' CD2' ' A' ' 151' ' ' PHE . 12.7 m-90 -51.87 -44.06 63.55 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 123.411 0.444 . . . . 4.1200000000000001 111.529 -176.278 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -62.71 -33.14 85.89 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 114.662 0.625 . . . . 0.80000000000000004 114.662 -176.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.641 ' HG2' ' ND2' ' A' ' 96' ' ' ASN . 81.5 mmt-85 -60.93 -38.72 86.79 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 117.632 0.716 . . . . 4.9100000000000001 110.38 -178.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.597 HG12 ' HG ' ' A' ' 138' ' ' LEU . 81.4 mt -75.17 -35.4 34.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 115.196 -0.911 . . . . 1.1100000000000001 111.281 -173.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.4 m -65.88 -33.78 65.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.549 -0.537 . . . . 2.0299999999999998 109.549 173.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.51 -48.04 71.05 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.218 0.532 . . . . 1.0600000000000001 109.603 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.466 ' CE1' ' HE2' ' A' ' 83' ' ' PHE . 42.8 t80 -50.48 -53.2 31.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.47 -1.241 . . . . 1.8400000000000001 111.931 178.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.529 ' HA ' ' HE2' ' A' ' 130' ' ' MET . 0.2 OUTLIER -80.08 -20.23 45.63 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.395 -0.522 . . . . 4.21 111.081 -175.027 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.639 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 31.3 t -75.01 -53.02 9.65 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.63 0.252 . . . . 1.55 110.382 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.497 ' CZ ' ' HB ' ' A' ' 86' ' ' VAL . 2.3 p90 -68.23 -22.08 64.8 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 109.599 -0.519 . . . . 3.6400000000000001 109.599 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.461 ' HA2' ' HB2' ' A' ' 110' ' ' LEU . . . -75.07 -40.87 33.67 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.687 -0.768 . . . . 0.32000000000000001 111.507 174.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.701 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -64.57 -33.98 88.69 Favored Glycine 0 N--CA 1.448 -0.5 0 N-CA-C 110.916 -0.874 . . . . 0.23999999999999999 110.916 174.246 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.95 -29.23 58.22 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.532 -0.334 . . . . 1.05 110.449 173.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.461 ' HB2' ' HA2' ' A' ' 107' ' ' GLY . 0.2 OUTLIER -62.73 -39.67 94.79 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 107.758 -1.201 . . . . 1.78 107.758 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.731 ' HG ' HG13 ' A' ' 123' ' ' VAL . 41.1 t -48.69 -60.32 2.82 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 113.362 -1.744 . . . . 0.90000000000000002 109.554 171.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.744 ' HA ' HG11 ' A' ' 115' ' ' VAL . 46.0 t -66.38 -31.65 54.54 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 CA-C-N 116.366 -0.379 . . . . 1.2 111.859 -178.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.537 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 22.5 mt-10 -57.52 -20.72 33.42 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 118.28 0.491 . . . . 2.5099999999999998 110.321 176.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.506 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 50.1 m -89.54 -44.93 9.76 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 108.465 -0.939 . . . . 0.28000000000000003 108.465 179.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.744 HG11 ' HA ' ' A' ' 112' ' ' VAL . 1.4 m -67.86 -29.07 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.106 0 CA-C-N 115.061 -0.972 . . . . 1.8300000000000001 109.623 -177.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -51.56 -50.62 59.73 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 113.379 -1.737 . . . . 0.59999999999999998 111.169 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.413 ' CG ' ' HE1' ' A' ' 119' ' ' MET . 31.5 mmtt -86.15 13.57 7.65 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.695 -0.684 . . . . 2.1600000000000001 109.811 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.57 ' HA ' HE21 ' A' ' 120' ' ' GLN . 23.9 mm-40 63.57 53.54 2.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 122.016 0.912 . . . . 1.8799999999999999 110.571 -177.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.464 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 27.1 mtm -132.27 39.83 3.37 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.197 -1.365 . . . . 1.0800000000000001 107.457 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.638 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 3.9 mp0 -53.54 -6.82 0.08 Allowed 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 114.685 -1.143 . . . . 1.1499999999999999 113.18 -178.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.561 HG21 HD22 ' A' ' 122' ' ' LEU . 21.1 m -67.71 -29.01 43.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.588 -0.695 . . . . 1.1899999999999999 111.973 175.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.561 HD22 HG21 ' A' ' 121' ' ' VAL . 3.8 mm? -65.06 -27.27 68.67 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.02 0.438 . . . . 1.0600000000000001 110.294 178.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.731 HG13 ' HG ' ' A' ' 111' ' ' CYS . 39.8 t -44.13 -46.4 2.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 114.384 -1.28 . . . . 1.0 112.165 -177.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.602 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 23.0 t -73.83 -43.28 59.22 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.325 -0.398 . . . . 1.6599999999999999 111.743 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.421 ' O ' ' HD1' ' A' ' 129' ' ' TRP . 8.6 ptm180 -72.24 -36.87 69.19 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.966 -0.293 . . . . 3.2999999999999998 110.264 -170.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.607 HD11 ' HA ' ' A' ' 111' ' ' CYS . 82.4 mt -55.45 -49.58 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.642 -0.254 . . . . 1.0600000000000001 111.323 174.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.561 ' HB1' HD22 ' A' ' 13' ' ' LEU . . . -58.2 -30.5 66.51 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.767 0.318 . . . . 1.1000000000000001 111.478 -178.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.09 -60.66 3.28 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.395 0.617 . . . . 1.1200000000000001 110.193 175.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.421 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 98.5 m95 -57.75 -41.8 82.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.648 -1.16 . . . . 4.7699999999999996 111.045 -178.071 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.529 ' HE2' ' HA ' ' A' ' 104' ' ' PHE . 87.5 mtp -59.11 -57.74 11.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.457 -0.338 . . . . 1.0900000000000001 111.416 -178.247 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.1 74.87 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.872 -0.331 . . . . 1.05 110.87 -177.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.408 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 22.4 m -68.02 -45.18 74.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.852 0.358 . . . . 1.1299999999999999 111.458 176.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.6 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 13.0 m-85 -63.78 -33.29 75.33 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.896 -0.321 . . . . 3.3500000000000001 110.422 177.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.794 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.7 tt -64.43 -50.95 65.58 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 108.354 -0.98 . . . . 1.5900000000000001 108.354 170.079 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . 0.408 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 2.3 m-80 -49.02 -60.83 2.44 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.651 0.611 . . . . 0.46000000000000002 112.651 -179.366 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -78.51 -44.91 23.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.931 0.396 . . . . 0.58999999999999997 111.941 -172.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . 0.6 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 14.5 m80 -90.54 -51.41 5.41 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.857 0.688 . . . . 2.3399999999999999 112.857 -170.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.794 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -85.37 -47.07 10.35 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 113.932 1.086 . . . . 1.8999999999999999 113.932 -168.844 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.675 ' HA ' HD11 ' A' ' 142' ' ' ILE . 37.7 tt0 -45.48 -52.72 21.56 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 112.891 0.7 . . . . 0.75 112.891 -173.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.569 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 51.5 Cg_exo -53.44 -48.97 19.08 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.717 1.612 . . . . 0.87 111.522 177.023 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -61.26 -46.1 91.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.332 -0.849 . . . . 1.4299999999999999 110.339 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.675 HD11 ' HA ' ' A' ' 139' ' ' GLU . 37.5 mt -48.46 -51.25 11.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.073 0.464 . . . . 1.1299999999999999 111.117 175.264 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.582 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 74.7 mm-40 -59.14 -32.92 70.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.453 -0.794 . . . . 0.57999999999999996 111.485 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.569 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 12.3 mm-40 -64.59 -21.13 66.62 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.585 0.707 . . . . 0.78000000000000003 110.871 177.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -106.76 11.86 29.75 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.0 -1.0 . . . . 0.93000000000000005 109.54 -175.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 113.62 -35.02 4.73 Favored Glycine 0 N--CA 1.439 -1.122 0 CA-C-N 114.525 -1.216 . . . . 0.56000000000000005 112.895 174.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 124.46 -170.86 16.57 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.664 -0.779 . . . . 0.48999999999999999 111.691 -177.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.532 ' NE1' HD13 ' A' ' 142' ' ' ILE . 4.4 m-90 -78.54 -33.46 47.84 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.565 0.221 . . . . 4.5199999999999996 111.099 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -65.28 -41.71 93.88 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.922 0.391 . . . . 1.96 110.309 178.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.464 ' O ' ' HB2' ' A' ' 153' ' ' GLU . 88.2 m -56.94 -35.85 69.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.868 -0.605 . . . . 1.24 111.197 177.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.6 ' CD2' ' HB3' ' A' ' 97' ' ' TRP . 53.5 t80 -58.92 -41.97 88.58 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.216 -0.447 . . . . 3.7200000000000002 110.552 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.551 HG11 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -72.81 -25.75 22.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.098 0.475 . . . . 1.8600000000000001 110.304 -179.039 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 150' ' ' THR . 62.0 mm-40 -60.81 -23.21 64.88 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.033 0.444 . . . . 1.6699999999999999 110.551 173.272 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.514 ' HB2' ' CD1' ' A' ' 155' ' ' TYR . 0.5 OUTLIER -105.5 -54.27 2.51 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.887 -0.597 . . . . 1.96 110.956 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . 0.514 ' CD1' ' HB2' ' A' ' 154' ' ' LEU . 88.8 m-85 -110.61 14.51 22.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.643 -0.708 . . . . 4.3899999999999997 111.242 -171.153 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.622 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -59.76 158.93 23.2 Favored Glycine 0 CA--C 1.504 -0.643 0 C-N-CA 121.251 -0.5 . . . . 1.1000000000000001 113.629 -175.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 . . . . . 0 C--N 1.316 -0.851 0 CA-C-N 113.94 -1.13 . . . . 1.29 110.947 178.751 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B 1005 ' ' GLY . . . . . 0.628 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.532 1.14 0 CA-C-O 120.942 0.19 . . . . 1.26 113.037 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -85.32 -47.8 9.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.103 0.478 . . . . 3.4500000000000002 111.165 171.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -82.68 -52.74 6.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.829 -0.623 . . . . 1.54 112.543 -168.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1008 ' ' LEU . . . . . . . . . . . . . 3.9 mm? -59.58 -58.56 8.04 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 123.172 0.295 . . . . 1.8999999999999999 110.542 -176.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 0.958 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . . . -32.35 -53.63 0.31 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 122.186 0.993 . . . . 1.45 112.059 170.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -68.69 -55.19 12.23 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 113.816 -1.538 . . . . 1.51 111.877 -176.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1011 ' ' PHE . . . . . 0.451 ' O ' ' OH ' ' A' ' 61' ' ' TYR . 48.9 m-85 -64.7 -23.27 67.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.199 -0.455 . . . . 2.0699999999999998 111.048 -178.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -72.19 -6.66 65.39 Favored Glycine 0 N--CA 1.446 -0.669 0 CA-C-N 116.006 -0.543 . . . . 0.80000000000000004 112.831 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -80.87 -2.26 46.69 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 111.757 0.28 . . . . 1.8999999999999999 111.757 177.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 2.4 m . . . . . 0 CA--C 1.53 0.191 0 O-C-N 121.793 -0.567 . . . . 1.4399999999999999 111.419 -174.03 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . 0.626 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 43.7 tp60 . . . . . 0 N--CA 1.455 -0.203 0 CA-C-O 121.264 0.554 . . . . 2.7599999999999998 109.69 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.5 p -76.33 -16.21 59.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.805 -0.634 . . . . 1.54 110.249 177.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.734 ' HA ' HD21 ' A' ' 8' ' ' LEU . 51.5 m-20 -66.81 -19.82 65.82 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.462 -0.57 . . . . 1.78 109.462 175.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.626 ' HB2' ' O ' ' A' ' 3' ' ' GLN . 2.5 mmt85 -51.01 -51.02 57.22 Favored 'General case' 0 CA--C 1.509 -0.607 0 CA-C-N 115.417 -0.811 . . . . 1.8999999999999999 110.522 176.257 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.428 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 43.5 mt-10 -56.38 -47.2 79.42 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.172 -0.922 . . . . 0.68000000000000005 111.163 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.734 HD21 ' HA ' ' A' ' 5' ' ' ASN . 1.2 mp -51.44 -31.58 23.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.508 -0.769 . . . . 1.8 111.21 176.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.444 HG21 ' CA ' ' A' ' 131' ' ' ALA . 77.9 t -83.1 -67.05 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.55 0.691 . . . . 1.0700000000000001 110.531 172.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 6' ' ' ARG . 51.1 t -50.28 -55.26 6.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.656 -1.156 . . . . 1.1299999999999999 113.515 -172.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -50.73 -33.33 22.55 Favored 'General case' 0 C--O 1.234 0.246 0 O-C-N 123.635 0.584 . . . . 0.58999999999999997 111.364 -174.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.65 ' HE1' ' HB3' ' A' ' 51' ' ' ARG . 98.9 m-85 -90.37 -35.57 15.12 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.838 -0.619 . . . . 2.02 112.37 -175.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 1.022 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 2.6 mp -60.12 -37.57 80.41 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 119.368 -0.933 . . . . 1.0600000000000001 108.93 174.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.424 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 39.8 t -58.75 -44.98 90.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.278 -0.873 . . . . 1.6000000000000001 110.68 175.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -66.9 -33.92 76.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.072 -0.513 . . . . 1.49 110.702 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.616 ' HG2' ' O ' ' A' ' 12' ' ' PHE . 8.5 mmpt? -68.97 -33.24 73.37 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.434 -0.348 . . . . 1.8400000000000001 110.962 -178.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.621 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -73.2 -30.02 63.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.876 0.37 . . . . 1.98 110.434 176.447 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.6 t -62.44 -36.15 81.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.911 -0.586 . . . . 1.3799999999999999 111.4 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -77.07 -1.91 31.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 1.51 111.664 -179.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.574 ' HE2' HG12 ' A' ' 112' ' ' VAL . 15.6 mmmt -111.75 -26.21 9.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.872 0.844 . . . . 2.6499999999999999 109.227 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.69 23.14 8.96 Favored Glycine 0 N--CA 1.441 -0.982 0 CA-C-N 113.978 -1.465 . . . . 0.54000000000000004 111.719 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.417 ' HE2' HE21 ' A' ' 120' ' ' GLN . 50.0 m-85 -113.66 164.69 13.36 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.023 -0.362 . . . . 1.1200000000000001 110.023 175.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.587 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 2.1 t -111.57 143.68 42.06 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.975 -0.557 . . . . 0.75 109.833 176.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.451 ' HZ2' ' HB2' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -66.5 -48.75 68.82 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.229 -0.441 . . . . 4.29 110.117 174.631 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.465 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 3.9 p -64.36 -27.84 69.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.5 . . . . 1.8600000000000001 111.919 -174.237 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.587 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 94.7 mt-30 -57.36 -33.65 68.01 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.203 0.525 . . . . 1.52 110.989 176.006 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -120.09 14.86 12.34 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.604 -0.726 . . . . 1.53 111.319 -170.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.563 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 72.5 p -100.98 179.89 4.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 122.074 0.94 . . . . 2.04 112.94 -172.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.626 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 21.4 t70 -168.69 -20.28 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 113.182 -1.827 . . . . 2.3100000000000001 107.933 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.652 HG22 ' H ' ' A' ' 31' ' ' GLU . 5.8 m -57.51 -71.8 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 114.171 -1.377 . . . . 1.4099999999999999 112.669 -176.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.652 ' H ' HG22 ' A' ' 30' ' ' VAL . 24.2 mm-40 -87.82 -2.92 58.92 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.668 -0.864 . . . . 2.7400000000000002 108.668 177.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.626 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 34.6 tt0 . . . . . 0 N--CA 1.437 -1.104 0 CA-C-N 114.6 -1.182 . . . . 1.45 109.378 -179.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.426 ' H ' HG23 ' A' ' 41' ' ' THR . 1.5 p . . . . . 0 N--CA 1.444 -0.756 0 N-CA-C 113.19 0.811 . . . . 1.45 113.19 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -29.3 -32.55 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.713 1.205 . . . . 2.02 113.454 169.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.706 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 2.7 p -30.74 -49.03 0.12 Allowed 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 114.228 1.196 . . . . 1.25 114.228 -177.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -40.27 -50.93 2.76 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.748 0.648 . . . . 1.9099999999999999 112.748 -173.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.39 -36.38 58.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.697 0.284 . . . . 1.1799999999999999 111.519 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.607 ' HA ' HG12 ' A' ' 152' ' ' VAL . 1.0 OUTLIER -74.25 -39.05 49.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.632 -0.258 . . . . 2.0099999999999998 111.344 -175.011 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.706 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.0 ptpt -67.37 -44.43 78.97 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.993 -0.743 . . . . 1.3799999999999999 108.993 174.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.443 ' H ' ' HG3' ' A' ' 47' ' ' LYS . 3.6 mm100 -54.12 -35.18 61.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.724 -0.671 . . . . 0.98999999999999999 112.038 174.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.57 ' HB1' ' HA2' ' A' ' 156' ' ' GLY . . . -80.66 -30.94 36.52 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.105 0.479 . . . . 1.1399999999999999 111.036 177.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.597 ' HG ' ' CE2' ' A' ' 104' ' ' PHE . 1.1 mp -68.34 -26.92 65.84 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.707 -0.679 . . . . 1.95 111.744 -176.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.65 ' HB3' ' HE1' ' A' ' 12' ' ' PHE . 5.3 ptp180 -80.83 -26.6 36.95 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.57 0.7 . . . . 2.5099999999999998 109.26 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -71.5 -54.33 10.92 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.592 -1.186 . . . . 1.1000000000000001 109.707 177.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.36 -39.31 93.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.724 -0.671 . . . . 1.04 110.454 176.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.698 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -58.22 -51.92 55.66 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.666 -0.697 . . . . 0.69999999999999996 112.003 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.549 ' O ' HD23 ' A' ' 59' ' ' LEU . 17.8 t70 -53.33 -40.89 65.2 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.956 0.408 . . . . 1.04 111.226 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.503 ' O ' HD21 ' A' ' 59' ' ' LEU . 44.2 mt-10 -75.27 -25.34 57.93 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.453 -0.794 . . . . 2.29 111.645 -179.018 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.891 ' HZ ' ' HA2' ' B' 1012 ' ' GLY . 8.0 t80 -85.38 -46.95 10.46 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.74 0.644 . . . . 2.9300000000000002 112.74 178.456 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.698 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 44.8 mt-10 -54.86 -52.12 63.81 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.737 0.643 . . . . 1.3 112.737 -166.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.549 HD23 ' O ' ' A' ' 55' ' ' ASP . 2.2 pt? -52.15 -34.25 43.94 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.196 -0.911 . . . . 2.1899999999999999 111.697 -174.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 -55.35 -55.15 34.81 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.466 -0.334 . . . . 3.1400000000000001 111.154 -178.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.598 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 47.4 p90 -93.03 -3.58 54.09 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.242 -0.435 . . . . 5.5899999999999999 111.775 -178.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.611 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 41.6 ttm180 -50.87 -36.04 35.78 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.746 0.647 . . . . 4.9299999999999997 112.746 -173.113 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -61.81 -31.59 71.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.605 0.24 . . . . 5.3499999999999996 111.512 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.622 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.06 -47.8 7.6 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.567 0.58 . . . . 1.7 112.567 -174.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.611 ' CD1' ' HA ' ' A' ' 62' ' ' ARG . 5.7 p90 -58.47 -27.09 64.09 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.703 0.631 . . . . 3.52 112.703 -166.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.0 t -70.58 -31.59 68.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.151 0.5 . . . . 2.5899999999999999 110.259 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -91.01 -24.96 19.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 2.7200000000000002 111.008 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 59.9 mt -59.76 -16.69 29.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.915 0.709 . . . . 2.25 112.915 -174.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.643 HG21 HG13 ' A' ' 74' ' ' ILE . 16.6 p -50.91 -35.89 35.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.113 0.482 . . . . 1.26 111.113 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 13.4 t -67.01 -34.72 78.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.402 -0.817 . . . . 1.8 110.755 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -78.54 -49.06 13.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.776 -0.647 . . . . 1.8899999999999999 110.289 -177.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.695 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.1 mt -67.06 -30.64 70.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.397 -0.819 . . . . 1.98 110.196 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.1 m80 68.58 61.31 0.36 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.922 0.868 . . . . 3.54 109.191 -177.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.643 HG13 HG21 ' A' ' 69' ' ' THR . 16.0 mm -64.93 123.54 17.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 114.009 -1.45 . . . . 1.1499999999999999 110.926 -178.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.775 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.1 -169.35 0.22 Allowed Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 107.515 -1.291 . . . . 1.1200000000000001 107.515 -169.872 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.775 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.5 Cg_exo -30.5 166.26 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.272 0 C-N-CA 124.722 3.614 . . . . 0.53000000000000003 114.875 164.69 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.24 -28.93 0.01 OUTLIER Glycine 0 N--CA 1.476 1.331 0 N-CA-C 117.089 1.596 . . . . 0.40999999999999998 117.089 -175.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.455 ' N ' ' O ' ' A' ' 76' ' ' PRO . 22.1 p -69.27 6.53 0.97 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 117.693 0.747 . . . . 1.22 111.695 178.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.3 -14.23 62.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.391 -0.596 . . . . 1.0700000000000001 109.391 169.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -75.48 -16.81 60.27 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.649 -0.705 . . . . 4.3099999999999996 109.348 174.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.468 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 76.5 mt-30 -83.8 -27.01 29.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.947 0.879 . . . . 1.03 109.635 173.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.695 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.8 m -72.1 -52.45 16.74 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.646 -1.161 . . . . 0.47999999999999998 109.187 171.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.449 ' HB2' ' HG ' ' A' ' 110' ' ' LEU . 75.6 t80 -65.03 -16.1 63.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.887 -1.051 . . . . 1.4399999999999999 110.005 174.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.651 ' HA ' HG13 ' A' ' 87' ' ' VAL . 34.1 tt0 -62.95 -50.14 71.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.975 0.416 . . . . 0.80000000000000004 110.288 176.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -44.32 -45.55 8.8 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 114.793 -1.094 . . . . 1.99 111.343 179.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.63 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.4 p -90.44 -39.21 11.79 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 CA-C-N 113.42 -1.718 . . . . 1.8999999999999999 111.77 -171.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.651 HG13 ' HA ' ' A' ' 84' ' ' GLU . 5.3 p -64.86 -23.4 33.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.894 0.854 . . . . 1.4299999999999999 109.063 176.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.1 m-80 -70.49 -46.09 64.4 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.309 -1.314 . . . . 0.91000000000000003 111.345 175.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 1.008 ' HB2' ' HB3' ' B' 1009 ' ' ALA . 0.7 OUTLIER -69.14 -36.4 77.41 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 108.59 -0.893 . . . . 2.8700000000000001 108.59 -179.222 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 86' ' ' VAL . 1.1 tp -69.58 -20.16 63.65 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 113.797 -1.547 . . . . 1.9199999999999999 111.783 -168.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.586 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 2.5 p90 -110.66 -12.3 14.34 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.441 -0.503 . . . . 2.9700000000000002 111.569 -175.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.552 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 9.0 ptm180 -98.46 -35.47 10.25 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.388 0.613 . . . . 5.6699999999999999 110.988 -179.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -82.93 5.05 23.24 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.323 -0.853 . . . . 3.1200000000000001 112.587 -167.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 131.26 67.49 0.1 OUTLIER Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 117.83 -2.129 . . . . 2.3100000000000001 114.724 -177.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.586 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 57.3 t -72.71 95.86 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 122.056 0.931 . . . . 1.6799999999999999 111.307 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -113.19 -171.0 1.79 Allowed 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.425 -1.261 . . . . 2.1200000000000001 108.868 173.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.646 ' HB3' ' HE2' ' A' ' 155' ' ' TYR . 15.7 m-90 -53.39 -54.23 39.77 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 123.475 0.484 . . . . 4.1200000000000001 111.345 -179.544 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.431 ' O ' ' HB ' ' A' ' 101' ' ' VAL . . . -77.17 -16.59 80.47 Favored Glycine 0 CA--C 1.52 0.381 0 C-N-CA 121.093 -0.575 . . . . 0.80000000000000004 113.775 -175.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.619 HH12 ' HA ' ' B' 1009 ' ' ALA . 7.5 tpp180 -67.36 -43.02 82.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.066 0.46 . . . . 4.9100000000000001 110.464 -178.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 85.5 mt -69.86 -31.78 49.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.3 0.572 . . . . 1.1100000000000001 110.488 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.612 ' HA ' ' CD2' ' A' ' 104' ' ' PHE . 59.8 t -52.96 -51.72 35.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.35 -0.841 . . . . 2.0299999999999998 110.352 172.42 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.31 -47.61 75.36 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.657 -0.701 . . . . 1.0600000000000001 110.841 175.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -57.32 -50.71 72.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.315 -0.857 . . . . 1.8400000000000001 112.357 -178.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.612 ' CD2' ' HA ' ' A' ' 101' ' ' VAL . 1.2 p90 -66.86 -36.18 81.73 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 120.584 -0.446 . . . . 4.21 110.404 -176.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 44.5 m -68.4 -40.73 81.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.253 -0.43 . . . . 1.55 110.501 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -71.56 -34.52 70.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.883 -0.599 . . . . 3.6400000000000001 110.402 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.494 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -62.49 -42.01 99.74 Favored Glycine 0 N--CA 1.444 -0.823 0 C-N-CA 120.367 -0.921 . . . . 0.32000000000000001 110.89 174.271 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 1.022 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.29 -28.32 73.43 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.788 -0.72 . . . . 0.23999999999999999 111.683 174.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.97 -35.12 50.59 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.907 -0.172 . . . . 1.05 110.636 176.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.449 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -59.64 -38.81 82.39 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 107.904 -1.146 . . . . 1.78 107.904 178.411 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.708 ' SG ' HG21 ' A' ' 123' ' ' VAL . 26.2 t -49.14 -63.12 1.19 Allowed 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 113.406 -1.725 . . . . 0.90000000000000002 109.824 171.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.757 ' HA ' HG13 ' A' ' 115' ' ' VAL . 42.5 t -62.27 -34.52 64.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 1.2 111.667 -177.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.503 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 32.8 mt-10 -57.0 -23.51 46.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.055 0.455 . . . . 2.5099999999999998 110.278 178.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 54.3 m -85.93 -43.62 13.07 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 108.479 -0.934 . . . . 0.28000000000000003 108.479 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.757 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.8 m -69.0 -29.04 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 CA-C-N 114.93 -1.032 . . . . 1.8300000000000001 109.787 -176.055 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -50.53 -49.93 54.49 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 113.165 -1.834 . . . . 0.59999999999999998 110.995 174.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.442 ' CG ' ' HE1' ' A' ' 119' ' ' MET . 33.9 mmtt -86.81 11.19 13.8 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.554 -0.748 . . . . 2.1600000000000001 110.019 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 64.03 52.75 1.98 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 122.146 0.974 . . . . 1.8799999999999999 110.137 -175.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.442 ' HE1' ' CG ' ' A' ' 117' ' ' LYS . 30.3 mtm -129.9 36.92 4.0 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.075 -1.42 . . . . 1.0800000000000001 107.531 179.118 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.742 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 11.7 mp0 -53.84 -7.95 0.15 Allowed 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.637 -1.165 . . . . 1.1499999999999999 113.24 -178.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.541 HG22 HD22 ' A' ' 122' ' ' LEU . 20.9 m -67.06 -20.51 27.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 O-C-N 121.671 -0.643 . . . . 1.1899999999999999 111.997 175.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.685 HD11 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -75.05 -25.07 58.38 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.029 0.442 . . . . 1.0600000000000001 110.077 177.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.708 HG21 ' SG ' ' A' ' 111' ' ' CYS . 42.3 t -45.52 -51.87 2.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.617 -1.174 . . . . 1.0 112.355 -177.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.563 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 7.1 t -75.24 -34.27 61.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.884 0.374 . . . . 1.6599999999999999 110.76 -178.38 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.685 ' HD2' HD11 ' A' ' 122' ' ' LEU . 74.2 mtt180 -64.06 -51.39 64.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.445 . . . . 3.2999999999999998 110.591 -176.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.549 HD11 ' HA ' ' A' ' 111' ' ' CYS . 73.4 mt -53.97 -50.05 56.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.572 -0.74 . . . . 1.0600000000000001 111.155 178.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -53.73 -36.11 61.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.893 0.378 . . . . 1.1000000000000001 111.517 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.5 -56.99 13.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.555 0.693 . . . . 1.1200000000000001 110.674 176.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -65.31 -32.01 73.44 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.809 -1.087 . . . . 4.7699999999999996 111.334 -176.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.543 ' SD ' HD11 ' A' ' 13' ' ' LEU . 90.3 mtp -64.51 -54.29 34.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.907 0.384 . . . . 1.0900000000000001 111.277 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.444 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -61.69 -41.02 97.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.027 -0.533 . . . . 1.05 111.151 -178.026 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 59.7 m -65.73 -43.24 89.65 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.808 -0.357 . . . . 1.1299999999999999 110.782 176.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.597 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 16.7 t80 -56.64 -40.11 74.88 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.707 -0.479 . . . . 3.3500000000000001 109.707 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.847 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.2 tt -61.1 -55.91 27.08 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.827 -0.805 . . . . 1.5900000000000001 108.827 172.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -50.63 -46.86 58.5 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.388 -0.823 . . . . 0.46000000000000002 112.862 -176.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -87.03 -47.43 8.94 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.127 0.489 . . . . 0.58999999999999997 111.8 -174.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . 0.597 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 66.8 m-70 -90.17 -50.89 5.74 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.829 -0.623 . . . . 2.3399999999999999 112.253 -170.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.847 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -85.07 -44.84 12.66 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 113.555 0.946 . . . . 1.8999999999999999 113.555 -168.52 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.649 ' HA ' HD13 ' A' ' 142' ' ' ILE . 29.6 tt0 -45.18 -51.25 25.41 Favored Pre-proline 0 C--N 1.32 -0.701 0 O-C-N 123.699 0.625 . . . . 0.75 112.596 -174.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.567 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 46.5 Cg_exo -55.7 -47.67 24.15 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 121.673 1.582 . . . . 0.87 111.591 175.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . 0.452 ' O ' ' HB2' ' A' ' 144' ' ' GLU . 0.1 OUTLIER -57.43 -48.18 79.83 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.507 -0.77 . . . . 1.4299999999999999 110.387 177.586 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.649 HD13 ' HA ' ' A' ' 139' ' ' GLU . 19.1 mt -51.54 -49.43 33.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.665 -0.698 . . . . 1.1299999999999999 111.531 175.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.618 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 80.5 mm-40 -60.98 -29.71 69.84 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.773 -0.649 . . . . 0.57999999999999996 111.263 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.567 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 13.2 mm-40 -64.57 -20.17 66.08 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 121.439 0.637 . . . . 0.78000000000000003 110.571 174.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.627 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -105.83 3.58 28.84 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.279 -0.873 . . . . 0.93000000000000005 109.517 -175.56 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.15 -30.47 6.76 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.157 -0.929 . . . . 0.56000000000000005 113.229 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . 0.414 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 113.42 159.72 13.65 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.252 -0.739 . . . . 0.48999999999999999 111.252 -175.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.513 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 81.4 m95 -55.74 -30.77 61.75 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.491 0.552 . . . . 4.5199999999999996 112.491 -174.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.506 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 14.1 p-10 -63.32 -41.29 98.91 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.669 -0.412 . . . . 1.96 109.955 177.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.544 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 54.3 m -65.94 -32.53 74.08 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.841 -0.618 . . . . 1.24 110.768 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.722 ' HD2' ' HH ' ' A' ' 155' ' ' TYR . 4.1 m-85 -60.28 -41.94 94.4 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.004 -0.544 . . . . 3.7200000000000002 110.13 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.607 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -77.09 -25.28 15.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.155 0.503 . . . . 1.8600000000000001 110.233 177.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.506 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 8.9 mm-40 -58.74 -20.82 52.68 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 121.967 -0.458 . . . . 1.6699999999999999 110.124 173.11 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 150' ' ' THR . 2.6 mt -99.36 -55.62 2.63 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.884 -0.598 . . . . 1.96 110.419 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . 0.722 ' HH ' ' HD2' ' A' ' 151' ' ' PHE . 26.8 p90 -121.89 30.24 6.74 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.626 0.727 . . . . 4.3899999999999997 112.402 -173.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.57 ' HA2' ' HB1' ' A' ' 49' ' ' ALA . . . -66.52 163.58 42.96 Favored Glycine 0 C--N 1.303 -1.291 0 CA-C-N 114.804 -1.089 . . . . 1.1000000000000001 113.738 -177.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 . . . . . 0 C--N 1.314 -0.976 0 CA-C-N 113.604 -1.298 . . . . 1.29 112.088 -177.968 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.389 0 N-CA-C 113.981 0.353 . . . . 1.26 113.981 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -107.21 -44.73 4.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 117.329 0.564 . . . . 3.4500000000000002 112.446 175.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1007 ' ' ALA . . . . . 0.456 ' HB1' HD11 ' B' 1008 ' ' LEU . . . -58.57 -64.24 1.0 Allowed 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 113.046 0.758 . . . . 1.54 113.046 -165.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.684 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 4.3 mp -71.0 -36.09 72.33 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-N 116.514 -0.312 . . . . 1.8999999999999999 110.352 -172.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 1.008 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . . . -42.28 -45.21 4.12 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.38 -0.827 . . . . 1.45 110.245 168.515 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -77.16 -40.41 45.54 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.463 -1.244 . . . . 1.51 111.681 -178.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -74.6 -30.27 61.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.784 0.326 . . . . 2.0699999999999998 111.312 -177.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1012 ' ' GLY . . . . . 0.891 ' HA2' ' HZ ' ' A' ' 57' ' ' PHE . . . -71.63 -11.45 72.81 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 116.07 -0.514 . . . . 0.80000000000000004 112.79 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.88 -17.11 60.63 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.171 0.51 . . . . 1.8999999999999999 110.311 174.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 9.4 m . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 121.291 0.567 . . . . 1.4399999999999999 110.304 -178.793 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 . . . . . 0 CA--C 1.529 0.167 0 N-CA-C 111.966 0.358 . . . . 2.7599999999999998 111.966 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -60.1 -24.35 64.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.133 -0.485 . . . . 1.54 111.273 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.505 ' HB2' HD13 ' A' ' 134' ' ' LEU . 6.2 p30 -57.45 -30.08 64.73 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.898 -0.592 . . . . 1.78 111.601 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.485 ' O ' HG21 ' A' ' 10' ' ' VAL . 18.5 tpp85 -55.51 -49.92 71.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.895 -0.593 . . . . 1.8999999999999999 110.959 178.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.523 ' CD ' ' HG ' ' A' ' 43' ' ' SER . 42.8 mt-10 -60.71 -43.13 98.21 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.679 -0.691 . . . . 0.68000000000000005 111.596 -176.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.8 mt -63.3 -34.84 78.57 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.237 -0.892 . . . . 1.8 109.534 -175.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.4 t -68.63 -63.83 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 115.51 -0.768 . . . . 1.0700000000000001 109.586 173.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.485 HG21 ' O ' ' A' ' 6' ' ' ARG . 97.9 t -49.55 -55.06 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.371 -0.831 . . . . 1.1299999999999999 113.033 -176.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -57.66 -33.25 68.12 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.201 0.313 . . . . 0.58999999999999997 111.067 -173.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.653 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 20.4 t80 -83.64 -39.32 20.41 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 120.573 -0.451 . . . . 2.02 111.464 -177.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.989 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.0 mp -58.04 -40.34 80.68 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 119.666 -0.813 . . . . 1.0600000000000001 109.286 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.43 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 47.8 t -60.08 -41.72 93.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.428 -0.806 . . . . 1.6000000000000001 110.548 175.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -66.08 -30.47 70.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.908 -0.587 . . . . 1.49 110.935 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.815 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 14.8 mmmt -73.05 -48.67 34.0 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 121.453 0.644 . . . . 1.8400000000000001 109.852 -178.378 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.575 HD21 ' SG ' ' A' ' 111' ' ' CYS . 10.8 mt -56.54 -33.27 65.92 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.516 -0.765 . . . . 1.98 111.002 172.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.8 t -68.23 -24.81 64.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.876 -0.602 . . . . 1.3799999999999999 111.893 -178.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.815 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 23.2 pt20 -77.18 -16.65 59.02 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-O 121.395 0.617 . . . . 1.51 110.304 -177.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.71 ' HZ1' HG12 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -105.04 -24.62 12.78 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.943 -1.026 . . . . 2.6499999999999999 109.365 -179.364 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.04 23.14 8.74 Favored Glycine 0 N--CA 1.439 -1.115 0 CA-C-N 114.189 -1.369 . . . . 0.54000000000000004 112.936 176.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -99.22 164.58 12.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.737 0.304 . . . . 1.1200000000000001 110.295 172.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.1 t -103.22 148.28 25.99 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.145 0.497 . . . . 0.75 110.671 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.629 ' HH2' ' HB3' ' A' ' 127' ' ' ALA . 58.3 t-105 -75.53 -54.26 7.29 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.433 -0.803 . . . . 4.29 109.557 174.509 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.1 m -62.4 -32.8 73.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.703 -0.68 . . . . 1.8600000000000001 111.948 -173.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -60.29 -28.83 68.4 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 111.921 0.341 . . . . 1.52 111.921 -178.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -117.27 -2.44 11.61 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.222 0.453 . . . . 1.53 112.222 -175.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.613 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 51.5 m -102.04 155.48 18.15 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-O 122.155 0.978 . . . . 2.04 113.181 -175.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -130.79 -0.22 4.29 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 113.321 -1.763 . . . . 2.3100000000000001 109.163 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.679 HG22 ' H ' ' A' ' 31' ' ' GLU . 4.9 m -59.99 -75.68 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.434 -1.257 . . . . 1.4099999999999999 113.239 -167.32 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.679 ' H ' HG22 ' A' ' 30' ' ' VAL . 33.1 mm-40 -92.03 -2.9 56.44 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.679 -0.859 . . . . 2.7400000000000002 108.679 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 . . . . . 0 N--CA 1.448 -0.543 0 CA-C-N 114.717 -1.129 . . . . 1.45 110.711 177.188 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.864 HG22 ' H ' ' A' ' 42' ' ' GLU . 1.8 t . . . . . 0 CA--C 1.544 0.74 0 N-CA-C 110.371 -0.233 . . . . 1.45 110.371 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.864 ' H ' HG22 ' A' ' 41' ' ' THR . 11.1 pt-20 -94.08 -30.44 14.66 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 123.011 1.386 . . . . 2.02 107.783 165.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.529 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.0 OUTLIER -60.86 -25.66 66.83 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 112.135 -2.302 . . . . 1.25 113.43 -171.245 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -53.08 -51.36 62.07 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 120.758 0.313 . . . . 1.9099999999999999 110.635 179.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.516 ' HB1' HG22 ' A' ' 152' ' ' VAL . . . -74.62 -35.6 62.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.07 0.462 . . . . 1.1799999999999999 110.212 178.301 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.682 ' HA ' ' CG1' ' A' ' 152' ' ' VAL . 95.1 t -58.91 -60.42 2.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.295 -0.866 . . . . 2.0099999999999998 111.372 179.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.577 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 11.6 ptpt -59.36 -35.57 74.15 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.258 -0.645 . . . . 1.3799999999999999 109.258 -178.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.702 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -66.63 -30.33 70.58 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.404 -0.817 . . . . 0.98999999999999999 110.654 -179.616 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.74 ' HB3' ' HA2' ' A' ' 156' ' ' GLY . . . -83.5 -38.46 21.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.243 0.544 . . . . 1.1399999999999999 110.463 176.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.503 HD12 ' CE2' ' A' ' 151' ' ' PHE . 0.8 OUTLIER -65.88 -27.31 68.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.382 -0.827 . . . . 1.95 111.576 -176.368 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.702 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 6.4 ptp180 -81.41 -24.11 37.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.385 0.612 . . . . 2.5099999999999998 109.494 -178.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -75.49 -44.97 41.15 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.927 -1.033 . . . . 1.1000000000000001 109.271 174.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.78 -43.58 95.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.512 -0.767 . . . . 1.04 109.885 173.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.637 ' O ' ' HG2' ' A' ' 58' ' ' GLU . . . -65.73 -32.82 84.21 Favored Glycine 0 C--O 1.221 -0.663 0 CA-C-N 115.356 -0.838 . . . . 0.69999999999999996 112.058 177.301 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -57.96 -48.02 81.22 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.842 -0.429 . . . . 1.04 109.842 178.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -66.42 -27.33 67.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.339 -0.846 . . . . 2.29 111.17 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.609 ' CE2' ' HA ' ' A' ' 102' ' ' ALA . 5.4 t80 -80.76 -27.86 36.64 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.32 -0.4 . . . . 2.9300000000000002 111.47 -178.222 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.637 ' HG2' ' O ' ' A' ' 54' ' ' GLY . 36.9 mm-40 -49.82 -69.04 0.13 Allowed 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 112.216 0.451 . . . . 1.3 112.216 -178.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.747 HD22 ' N ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -53.98 -35.45 61.84 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.248 -0.887 . . . . 2.1899999999999999 111.343 -179.443 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.747 ' N ' HD22 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -51.63 -62.07 1.85 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.607 -0.724 . . . . 3.1400000000000001 112.33 175.681 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.446 ' HD1' ' HB3' ' A' ' 65' ' ' PHE . 31.1 p90 -90.98 -11.41 39.01 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 112.022 0.378 . . . . 5.5899999999999999 112.022 -175.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.741 ' HG3' ' HE1' ' A' ' 65' ' ' PHE . 43.0 ttm180 -62.38 -29.72 70.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.674 0.273 . . . . 4.9299999999999997 111.277 -175.806 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -64.84 -35.14 80.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.345 -0.389 . . . . 5.3499999999999996 110.622 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.424 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -91.52 -50.4 5.8 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.396 0.517 . . . . 1.7 112.396 -176.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.944 ' HA ' ' HB2' ' A' ' 68' ' ' LEU . 1.3 p90 -57.59 -27.32 62.61 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 112.581 0.586 . . . . 3.52 112.581 -166.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.6 p -64.29 -33.35 75.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.01 0.433 . . . . 2.5899999999999999 110.539 177.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -90.28 -32.45 16.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.496 0.665 . . . . 2.7200000000000002 109.738 174.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.944 ' HB2' ' HA ' ' A' ' 65' ' ' PHE . 3.3 mp -60.1 -19.73 54.79 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-N 115.205 -0.907 . . . . 2.25 112.506 -177.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.651 HG21 HG13 ' A' ' 74' ' ' ILE . 1.3 p -58.15 -28.43 64.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 118.29 0.496 . . . . 1.26 111.114 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 21.8 t -71.53 -37.3 71.19 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 109.365 -0.606 . . . . 1.8 109.365 173.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.453 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 13.2 mt-30 -68.44 -40.18 81.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.432 -0.804 . . . . 1.8899999999999999 110.088 178.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.491 HD22 ' O ' ' A' ' 68' ' ' LEU . 3.0 mm? -68.72 -32.56 72.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.609 -0.269 . . . . 1.98 110.64 172.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.5 m80 60.84 49.23 6.19 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.476 -0.935 . . . . 3.54 108.476 -170.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.651 HG13 HG21 ' A' ' 69' ' ' THR . 33.1 mm -51.3 113.05 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 113.805 -1.543 . . . . 1.1499999999999999 112.325 -176.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.778 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -154.55 -172.93 0.34 Allowed Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 107.522 -1.288 . . . . 1.1200000000000001 107.522 -171.804 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.778 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.4 Cg_exo -29.91 166.28 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.332 0 C-N-CA 125.185 3.923 . . . . 0.53000000000000003 115.466 166.224 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.513 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -29.26 -31.2 0.01 OUTLIER Glycine 0 N--CA 1.472 1.048 0 N-CA-C 117.307 1.683 . . . . 0.40999999999999998 117.307 -173.233 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 76' ' ' PRO . 18.2 p -66.14 2.03 1.3 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 117.653 0.726 . . . . 1.22 112.243 -179.065 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.25 -12.46 61.69 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.182 0.515 . . . . 1.0700000000000001 110.012 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.513 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 5.5 p90 -73.58 -21.76 60.25 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 109.212 -0.662 . . . . 4.3099999999999996 109.212 175.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.441 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 37.4 mt-30 -80.82 -25.58 37.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.867 0.841 . . . . 1.03 109.553 175.186 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.9 m -71.34 -51.67 22.96 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 114.482 -1.235 . . . . 0.47999999999999998 109.524 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.577 ' HE1' ' HB2' ' A' ' 106' ' ' PHE . 78.5 t80 -68.87 -18.65 64.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.057 -0.974 . . . . 1.4399999999999999 110.467 176.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.61 ' HA ' HG11 ' A' ' 87' ' ' VAL . 37.4 tt0 -59.51 -49.25 78.5 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.391 -0.822 . . . . 0.80000000000000004 110.339 176.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -48.45 -32.6 7.99 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.805 -1.089 . . . . 1.99 110.737 176.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.773 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -83.83 -53.07 11.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.803 -1.09 . . . . 1.8999999999999999 110.815 -177.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.61 HG11 ' HA ' ' A' ' 84' ' ' GLU . 7.6 p -61.44 -23.92 32.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.492 0.663 . . . . 1.4299999999999999 109.602 -179.057 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.686 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.6 m-80 -68.47 -52.77 28.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.581 -1.191 . . . . 0.91000000000000003 111.102 174.11 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.908 ' HB2' ' HB3' ' B' 1009 ' ' ALA . 0.8 OUTLIER -63.22 -36.54 83.98 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 121.881 0.848 . . . . 2.8700000000000001 108.762 -178.303 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.625 ' HG ' ' CD ' ' A' ' 89' ' ' GLU . 19.1 mt -68.89 -22.35 64.19 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 113.731 -1.577 . . . . 1.9199999999999999 112.527 -167.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.717 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 5.6 p90 -106.79 -32.11 8.1 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 120.494 -0.483 . . . . 2.9700000000000002 111.842 -174.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.686 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.0 OUTLIER -81.54 -24.41 36.62 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.243 0.544 . . . . 5.6699999999999999 110.854 -172.689 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.47 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 0.4 OUTLIER -98.53 18.52 16.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.518 -0.764 . . . . 3.1200000000000001 112.713 -170.249 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 116.19 68.88 0.42 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 117.829 -2.129 . . . . 2.3100000000000001 114.756 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.717 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 63.5 t -70.49 105.39 1.42 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 CA-C-N 118.276 1.038 . . . . 1.6799999999999999 111.277 -176.293 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.442 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 3.5 p30 -110.12 -170.66 1.69 Allowed 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 113.675 -1.602 . . . . 2.1200000000000001 108.229 172.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.817 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 23.2 m-90 -62.86 -35.06 78.73 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.84 0.352 . . . . 4.1200000000000001 110.633 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -73.75 -38.47 50.05 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.996 -0.547 . . . . 0.80000000000000004 113.697 -176.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.442 ' HG2' ' ND2' ' A' ' 96' ' ' ASN . 16.1 mmt180 -54.19 -31.74 53.75 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.225 0.536 . . . . 4.9100000000000001 111.563 -178.515 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.431 HG12 ' HG ' ' A' ' 138' ' ' LEU . 78.9 mt -83.19 -34.16 10.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.954 -0.566 . . . . 1.1100000000000001 111.653 -174.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.449 ' HA ' ' CD1' ' A' ' 104' ' ' PHE . 1.1 m -66.93 -25.97 35.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 109.344 -0.613 . . . . 2.0299999999999998 109.344 171.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.609 ' HA ' ' CE2' ' A' ' 57' ' ' PHE . . . -68.5 -51.87 38.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.194 0.521 . . . . 1.0600000000000001 109.71 172.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -49.37 -54.56 16.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.5 -1.227 . . . . 1.8400000000000001 111.936 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.888 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 0.3 OUTLIER -73.49 -19.08 61.03 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 120.645 -0.422 . . . . 4.21 111.441 -172.844 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.653 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 67.9 m -77.31 -49.27 15.35 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.509 0.195 . . . . 1.55 110.653 177.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.642 ' CZ ' HD13 ' B' 1008 ' ' LEU . 19.2 m-85 -60.51 -39.55 88.18 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 110.092 -0.336 . . . . 3.6400000000000001 110.092 177.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.879 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.99 -38.98 94.63 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.875 -0.678 . . . . 0.32000000000000001 111.959 177.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.989 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.6 -40.8 99.04 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.612 -0.804 . . . . 0.23999999999999999 111.362 175.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.13 -32.2 66.71 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.771 0.32 . . . . 1.05 110.76 177.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.524 ' HB3' HD12 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -58.31 -39.89 80.58 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 108.377 -0.972 . . . . 1.78 108.377 179.48 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.742 ' SG ' HG21 ' A' ' 123' ' ' VAL . 40.1 t -51.25 -64.11 0.92 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 113.713 -1.585 . . . . 0.90000000000000002 110.247 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.71 HG12 ' HZ1' ' A' ' 20' ' ' LYS . 44.6 t -61.57 -37.17 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-N 116.508 -0.314 . . . . 1.2 111.826 -175.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.499 ' HG3' ' CG2' ' A' ' 69' ' ' THR . 4.0 mm-40 -60.21 -21.81 62.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.105 0.479 . . . . 2.5099999999999998 110.67 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.415 ' HB2' ' O ' ' A' ' 111' ' ' CYS . 70.3 m -83.74 -42.77 16.19 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 108.061 -1.088 . . . . 0.28000000000000003 108.061 179.071 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.709 ' HA ' ' HG3' ' A' ' 120' ' ' GLN . 1.6 m -68.9 -28.79 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-N 114.796 -1.093 . . . . 1.8300000000000001 109.515 -177.44 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -51.67 -51.03 59.1 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 113.26 -1.791 . . . . 0.59999999999999998 110.919 174.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.436 ' CG ' ' HE2' ' A' ' 119' ' ' MET . 15.5 mmtp -84.7 13.92 5.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.523 -0.762 . . . . 2.1600000000000001 110.285 179.22 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 65.31 46.12 2.71 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.95 0.881 . . . . 1.8799999999999999 109.976 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.439 ' HE1' ' HB2' ' A' ' 119' ' ' MET . 26.8 mtm -126.7 38.24 4.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.559 -1.201 . . . . 1.0800000000000001 107.889 -178.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.709 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 10.2 mp0 -54.68 -8.05 0.21 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 114.775 -1.102 . . . . 1.1499999999999999 113.048 -179.367 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.588 HG23 HD21 ' A' ' 122' ' ' LEU . 16.5 m -64.0 -27.56 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 O-C-N 121.831 -0.543 . . . . 1.1899999999999999 111.477 174.051 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.588 HD21 HG23 ' A' ' 121' ' ' VAL . 3.2 mm? -70.04 -25.48 63.58 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 110.235 -0.284 . . . . 1.0600000000000001 110.235 178.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.742 HG21 ' SG ' ' A' ' 111' ' ' CYS . 55.2 t -47.7 -51.38 7.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.587 -0.733 . . . . 1.0 111.819 -178.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.613 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 14.6 t -75.62 -31.48 59.89 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.881 0.372 . . . . 1.6599999999999999 110.598 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.5 ' O ' ' HD1' ' A' ' 129' ' ' TRP . 58.6 mtp180 -66.42 -55.25 16.66 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 116.205 -0.452 . . . . 3.2999999999999998 110.418 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.537 HD13 ' HA ' ' A' ' 111' ' ' CYS . 87.7 mt -53.64 -42.82 52.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.591 -0.731 . . . . 1.0600000000000001 111.799 -175.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.629 ' HB3' ' HH2' ' A' ' 24' ' ' TRP . . . -60.27 -35.0 74.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.923 -0.311 . . . . 1.1000000000000001 110.89 178.371 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.15 -59.76 4.04 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.636 0.731 . . . . 1.1200000000000001 109.832 176.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.5 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 94.3 m95 -54.05 -46.15 71.86 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.251 -1.34 . . . . 4.7699999999999996 110.437 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.888 ' HE3' ' HA ' ' A' ' 104' ' ' PHE . 1.4 mmm -59.15 -59.41 5.51 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.784 -0.644 . . . . 1.0900000000000001 112.067 -177.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -59.81 -36.05 75.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 120.685 -0.406 . . . . 1.05 110.392 -177.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.411 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 23.3 m -64.49 -49.22 72.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.601 -0.272 . . . . 1.1299999999999999 111.571 176.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.485 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 14.1 m-85 -58.0 -36.37 72.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.766 0.317 . . . . 3.3500000000000001 110.351 178.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.704 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.5 tt -64.85 -51.06 64.09 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.986 -0.746 . . . . 1.5900000000000001 108.986 171.81 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . 0.411 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 4.5 m-80 -48.7 -49.59 37.2 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.07 0.548 . . . . 0.46000000000000002 112.034 178.392 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -80.15 -50.59 10.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.258 -0.428 . . . . 0.58999999999999997 111.897 -174.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . 0.485 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 22.2 m-70 -90.69 -51.69 5.25 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.067 0.765 . . . . 2.3399999999999999 113.067 -170.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.704 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -82.71 -45.89 13.87 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.291 0.848 . . . . 1.8999999999999999 113.291 -167.078 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.682 ' HA ' HD12 ' A' ' 142' ' ' ILE . 22.8 tt0 -42.08 -53.64 8.24 Favored Pre-proline 0 CA--C 1.542 0.652 0 O-C-N 124.123 0.89 . . . . 0.75 113.167 -172.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.468 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 19.3 Cg_endo -61.09 -47.6 12.12 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.889 1.726 . . . . 0.87 111.998 178.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -55.37 -46.92 76.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.72 -0.673 . . . . 1.4299999999999999 110.065 177.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.682 HD12 ' HA ' ' A' ' 139' ' ' GLU . 48.4 mt -49.08 -52.06 11.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.793 -0.64 . . . . 1.1299999999999999 111.798 175.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.519 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.8 mm-40 -59.9 -30.67 69.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.984 -0.553 . . . . 0.57999999999999996 111.434 -179.061 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.7 mm-40 -65.63 -20.81 66.46 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.705 0.764 . . . . 0.78000000000000003 110.594 176.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -111.29 10.92 21.67 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.002 -0.999 . . . . 0.93000000000000005 109.917 -175.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 114.39 -46.84 1.11 Allowed Glycine 0 N--CA 1.44 -1.044 0 CA-C-N 114.861 -1.063 . . . . 0.56000000000000005 112.813 173.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . 0.562 ' HA2' HG21 ' A' ' 142' ' ' ILE . . . 131.56 178.46 15.49 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.717 -0.754 . . . . 0.48999999999999999 111.9 -177.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.531 ' NE1' HD11 ' A' ' 142' ' ' ILE . 7.0 m-90 -68.54 -41.9 79.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.62 0.248 . . . . 4.5199999999999996 110.778 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.418 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 23.3 t70 -59.84 -37.75 80.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.32 0.581 . . . . 1.96 109.862 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.634 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 62.2 m -60.93 -37.53 82.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.306 -0.861 . . . . 1.24 111.183 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.817 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 74.6 t80 -59.33 -40.53 86.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.059 0.457 . . . . 3.7200000000000002 109.954 177.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.682 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -74.6 -24.89 18.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.475 0.655 . . . . 1.8600000000000001 110.094 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 31.8 mm-40 -66.38 -22.9 66.25 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.396 0.617 . . . . 1.6699999999999999 110.082 172.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.634 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.7 mt -93.82 -58.53 2.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.648 -0.705 . . . . 1.96 110.552 177.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -122.07 30.16 6.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.047 -0.524 . . . . 4.3899999999999997 111.594 -173.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.74 ' HA2' ' HB3' ' A' ' 49' ' ' ALA . . . -62.95 155.72 41.87 Favored Glycine 0 CA--C 1.502 -0.764 0 CA-C-O 121.654 0.585 . . . . 1.1000000000000001 113.682 -177.437 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 . . . . . 0 C--N 1.312 -1.059 0 CA-C-N 113.842 -1.179 . . . . 1.29 110.283 175.466 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B 1005 ' ' GLY . . . . . 0.77 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.53 1.008 0 CA-C-O 120.754 0.085 . . . . 1.26 112.954 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -89.23 -51.47 5.56 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.846 0.355 . . . . 3.4500000000000002 111.281 174.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -69.07 -62.83 1.22 Allowed 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 113.244 0.831 . . . . 1.54 113.244 -167.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.642 HD13 ' CZ ' ' A' ' 106' ' ' PHE . 3.2 mm? -58.63 -53.23 60.72 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.149 -0.315 . . . . 1.8999999999999999 110.149 -176.307 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 0.908 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . . . -38.0 -50.43 1.33 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.102 -0.954 . . . . 1.45 111.991 171.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -70.2 -47.88 59.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.084 -0.962 . . . . 1.51 111.706 -177.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -66.52 -27.42 67.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.007 0.432 . . . . 2.0699999999999998 111.247 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.67 -11.14 80.54 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.939 -0.573 . . . . 0.80000000000000004 112.905 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 36.0 t70 -76.51 -5.32 47.04 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.17 0.509 . . . . 1.8999999999999999 110.647 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 10.0 m . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 116.09 -0.505 . . . . 1.4399999999999999 111.053 -177.721 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 120.69 0.281 . . . . 2.7599999999999998 110.812 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.1 t -86.67 -22.58 26.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.963 0.411 . . . . 1.54 110.731 -177.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.765 ' HA ' HD22 ' A' ' 8' ' ' LEU . 8.2 p30 -67.75 -22.66 65.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.106 0.479 . . . . 1.78 110.05 173.236 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.937 HH12 ' HA ' ' A' ' 128' ' ' ALA . 21.1 tpp180 -55.56 -49.6 72.26 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 115.263 -0.88 . . . . 1.8999999999999999 109.778 175.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.478 ' CD ' ' HG ' ' A' ' 43' ' ' SER . 32.3 mt-10 -56.3 -52.28 65.09 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.475 -1.239 . . . . 0.68000000000000005 111.176 -177.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.765 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.8 OUTLIER -44.54 -43.73 8.21 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.269 -0.878 . . . . 1.8 111.167 175.733 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 76.1 t -72.17 -61.41 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.337 0.589 . . . . 1.0700000000000001 110.482 176.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' ' 6' ' ' ARG . 68.2 t -52.91 -52.71 26.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.062 -0.972 . . . . 1.1299999999999999 113.036 -174.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -55.7 -34.52 65.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.066 0.46 . . . . 0.58999999999999997 110.549 -175.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.681 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 24.2 t80 -80.38 -43.01 21.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 116.102 -0.499 . . . . 2.02 111.132 -178.052 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.828 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 3.9 mp -59.02 -41.63 88.24 Favored 'General case' 0 CA--C 1.522 -0.113 0 C-N-CA 120.066 -0.654 . . . . 1.0600000000000001 109.526 176.408 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -55.58 -43.21 75.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.641 -0.709 . . . . 1.6000000000000001 110.604 176.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -71.45 -33.61 69.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.416 -0.811 . . . . 1.49 110.831 -177.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.68 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 9.9 mmpt? -76.54 -27.87 56.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.509 -0.314 . . . . 1.8400000000000001 111.593 -177.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.592 HD21 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -73.55 -29.51 62.49 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 120.103 -0.639 . . . . 1.98 109.871 174.512 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.3 t -65.57 -28.83 69.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.79 -0.641 . . . . 1.3799999999999999 111.526 -176.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 28.5 pt20 -79.14 -5.88 55.21 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.433 0.635 . . . . 1.51 110.86 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.519 ' HG3' HG12 ' A' ' 112' ' ' VAL . 18.6 mmmt -108.77 -25.17 10.95 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 122.148 0.975 . . . . 2.6499999999999999 108.946 -179.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.81 25.78 7.88 Favored Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 113.605 -1.634 . . . . 0.54000000000000004 111.227 179.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -120.33 166.74 13.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.315 -0.442 . . . . 1.1200000000000001 110.669 177.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.497 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 4.6 t -112.35 149.8 31.96 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.071 -0.513 . . . . 0.75 110.327 178.25 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.424 ' CE2' HG12 ' A' ' 10' ' ' VAL . 2.8 t90 -67.63 -50.65 56.99 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.031 0.443 . . . . 4.29 109.963 172.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.496 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 3.8 p -64.08 -31.65 72.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.559 -0.746 . . . . 1.8600000000000001 111.738 -171.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.497 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 95.0 mt-30 -56.4 -27.42 56.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.924 0.392 . . . . 1.52 111.371 178.046 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -120.61 11.33 11.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.26 -0.427 . . . . 1.53 111.382 -175.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.567 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 59.0 p -98.02 -178.05 3.95 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.784 0.661 . . . . 2.04 112.784 -170.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.531 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 11.1 t70 -170.66 -26.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 114.649 -1.16 . . . . 2.3100000000000001 109.441 -177.408 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.65 HG23 ' H ' ' A' ' 31' ' ' GLU . 6.6 m -47.43 -72.21 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-N 114.586 -1.188 . . . . 1.4099999999999999 112.866 -174.077 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.65 ' H ' HG23 ' A' ' 30' ' ' VAL . 7.9 pt-20 -102.48 1.17 34.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.483 0.659 . . . . 2.7400000000000002 109.386 175.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.531 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 15.5 tt0 . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 115.017 -0.992 . . . . 1.45 111.435 -179.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.893 HG22 ' H ' ' A' ' 42' ' ' GLU . 1.8 t . . . . . 0 CA--C 1.538 0.497 0 N-CA-C 109.29 -0.633 . . . . 1.45 109.29 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.893 ' H ' HG22 ' A' ' 41' ' ' THR . 13.7 pt-20 -93.28 -29.87 15.45 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 122.66 1.219 . . . . 2.02 108.418 164.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.664 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 6.7 p -60.42 -23.35 64.31 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 112.595 -2.093 . . . . 1.25 113.77 -170.241 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -55.91 -46.02 78.54 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.124 -0.63 . . . . 1.9099999999999999 109.9 179.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.483 ' HB2' HG21 ' A' ' 152' ' ' VAL . . . -76.57 -34.94 58.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.071 0.462 . . . . 1.1799999999999999 110.35 177.04 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.664 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 88.1 t -61.06 -61.08 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.514 -0.766 . . . . 2.0099999999999998 111.302 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.428 ' HB3' HD13 ' A' ' 8' ' ' LEU . 10.1 ptpt -59.91 -34.74 73.6 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.088 -0.708 . . . . 1.3799999999999999 109.088 -178.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.632 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 5.4 mm100 -64.79 -41.49 95.8 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.729 -0.669 . . . . 0.98999999999999999 110.393 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.72 ' HB3' ' HA2' ' A' ' 156' ' ' GLY . . . -67.71 -36.38 80.51 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.336 0.589 . . . . 1.1399999999999999 110.392 175.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.547 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.2 mp -72.41 -24.14 61.19 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.411 -0.813 . . . . 1.95 111.524 -178.255 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.632 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -81.31 -18.48 45.63 Favored 'General case' 0 CA--C 1.509 -0.613 0 C-N-CA 119.453 -0.899 . . . . 2.5099999999999998 109.027 178.0 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.501 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 4.3 mm-40 -80.46 -54.38 5.74 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.597 -1.183 . . . . 1.1000000000000001 109.983 175.302 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.83 -41.11 99.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.38 -0.827 . . . . 1.04 109.907 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.669 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -64.04 -43.61 97.08 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.299 -0.864 . . . . 0.69999999999999996 111.413 175.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 51' ' ' ARG . 19.1 t70 -52.85 -50.11 64.42 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.432 0.293 . . . . 1.04 110.964 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.718 ' O ' ' HG2' ' A' ' 60' ' ' ARG . 41.4 mt-10 -65.32 -28.22 69.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.138 -0.483 . . . . 2.29 110.955 179.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.509 ' HE2' ' HB3' ' A' ' 102' ' ' ALA . 0.3 OUTLIER -81.09 -19.86 42.75 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.388 -0.369 . . . . 2.9300000000000002 111.983 177.732 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.669 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 92.1 mt-10 -62.57 -57.07 12.44 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 122.516 -0.115 . . . . 1.3 111.15 -178.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.772 ' HA ' ' HB2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -62.99 -31.96 73.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.727 -0.215 . . . . 2.1899999999999999 111.255 179.191 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.718 ' HG2' ' O ' ' A' ' 56' ' ' GLU . 18.7 mmt180 -50.2 -52.03 39.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.231 -0.441 . . . . 3.1400000000000001 110.8 173.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.455 ' HB2' ' CZ ' ' A' ' 65' ' ' PHE . 28.9 m-85 -92.47 -3.83 54.57 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.206 -0.452 . . . . 5.5899999999999999 111.827 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.772 ' HB2' ' HA ' ' A' ' 59' ' ' LEU . 21.7 tpp180 -50.43 -50.81 51.04 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.577 0.584 . . . . 4.9299999999999997 112.577 -171.058 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -71.41 -16.29 62.39 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.191 0.519 . . . . 5.3499999999999996 111.084 -177.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.511 ' O ' HD12 ' A' ' 68' ' ' LEU . . . -90.2 -38.98 13.09 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.498 0.555 . . . . 1.7 112.498 -172.436 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.455 ' CZ ' ' HB2' ' A' ' 61' ' ' TYR . 44.8 m-85 -45.56 -46.46 14.16 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.247 0.832 . . . . 3.52 113.247 -170.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.9 t -66.27 -27.14 67.71 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.086 0.47 . . . . 2.5899999999999999 111.215 -174.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -88.56 -34.49 17.34 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.497 0.665 . . . . 2.7200000000000002 109.502 176.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.686 ' O ' HD11 ' A' ' 72' ' ' LEU . 5.5 mp -66.45 -31.37 72.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.139 -0.937 . . . . 2.25 112.595 -176.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.691 HG21 HG13 ' A' ' 74' ' ' ILE . 11.7 p -61.17 -24.23 66.16 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.109 -0.636 . . . . 1.26 110.661 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.1 t -77.65 -41.02 39.75 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.824 -0.625 . . . . 1.8 109.391 172.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.617 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 12.9 mt-30 -61.03 -49.48 77.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.369 -0.832 . . . . 1.8899999999999999 110.588 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.707 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.2 mp -75.53 -31.33 60.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.63 -0.713 . . . . 1.98 110.603 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 48.0 m80 65.92 59.69 0.7 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.64 0.733 . . . . 3.54 109.131 -172.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.691 HG13 HG21 ' A' ' 69' ' ' THR . 23.6 mm -59.29 112.79 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.4 -1.273 . . . . 1.1499999999999999 111.382 -178.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.747 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -153.07 -171.97 0.3 Allowed Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 107.781 -1.192 . . . . 1.1200000000000001 107.781 -170.029 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.747 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 21.7 Cg_exo -30.25 166.2 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 124.911 3.74 . . . . 0.53000000000000003 114.935 165.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.501 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -29.59 -30.23 0.01 OUTLIER Glycine 0 N--CA 1.472 1.058 0 N-CA-C 117.282 1.673 . . . . 0.40999999999999998 117.282 -172.085 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.457 ' N ' ' O ' ' A' ' 76' ' ' PRO . 32.2 p -67.87 6.12 0.75 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 118.019 0.909 . . . . 1.22 112.157 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.57 -12.92 61.87 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.962 0.411 . . . . 1.0700000000000001 109.982 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.501 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 5.0 p90 -78.26 -16.34 57.89 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.15 0.5 . . . . 4.3099999999999996 109.68 175.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.511 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 32.3 mt-30 -84.78 -24.51 28.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.775 0.798 . . . . 1.03 109.604 171.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.707 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 13.0 m -73.46 -52.1 14.84 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 114.566 -1.197 . . . . 0.47999999999999998 109.361 172.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.517 ' HA ' HG23 ' A' ' 86' ' ' VAL . 86.9 t80 -67.14 -17.02 64.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.183 -0.917 . . . . 1.4399999999999999 109.908 175.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.634 ' HA ' HG13 ' A' ' 87' ' ' VAL . 43.0 tt0 -58.54 -48.86 79.47 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.033 -0.531 . . . . 0.80000000000000004 110.195 174.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -47.14 -35.45 7.24 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.176 -0.92 . . . . 1.99 110.917 174.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.729 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.7 t -82.14 -49.91 16.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 114.534 -1.212 . . . . 1.8999999999999999 110.503 -175.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.634 HG13 ' HA ' ' A' ' 84' ' ' GLU . 8.4 p -62.8 -21.35 27.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 O-C-N 121.494 -0.754 . . . . 1.4299999999999999 109.991 179.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.464 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 3.0 m-80 -78.44 -37.34 43.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.373 -1.285 . . . . 0.91000000000000003 112.475 177.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 1.078 ' HB2' ' HB1' ' B' 1009 ' ' ALA . 1.3 pp20? -73.38 -29.27 62.52 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 108.904 -0.776 . . . . 2.8700000000000001 108.904 175.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.747 ' HB3' ' NH1' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -72.72 -35.82 67.65 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-N 114.549 -1.205 . . . . 1.9199999999999999 111.401 -168.087 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.464 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -103.87 12.91 33.85 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.136 0.493 . . . . 2.9700000000000002 110.918 -173.168 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.892 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -51.91 -43.12 63.26 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.404 -0.816 . . . . 5.6699999999999999 112.09 -178.318 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.853 ' HB3' HD22 ' A' ' 96' ' ' ASN . 14.7 t70 -74.0 -23.12 59.39 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 122.066 0.936 . . . . 3.1200000000000001 110.371 177.113 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.819 ' O ' HG21 ' A' ' 95' ' ' VAL . . . 131.03 -38.7 1.89 Allowed Glycine 0 N--CA 1.436 -1.307 0 CA-C-N 114.037 -1.438 . . . . 2.3100000000000001 110.245 177.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.819 HG21 ' O ' ' A' ' 94' ' ' GLY . 2.7 t 172.88 135.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.347 0.488 0 C-N-CA 126.96 2.104 . . . . 1.6799999999999999 108.388 160.075 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.853 HD22 ' HB3' ' A' ' 93' ' ' ASP . 2.9 m120 -111.35 147.14 35.79 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.431 -0.581 . . . . 2.1200000000000001 109.431 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.556 ' HA ' ' CE3' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -54.51 -46.49 73.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.188 0.518 . . . . 4.1200000000000001 110.581 177.437 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -79.32 -19.57 71.49 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.925 -0.655 . . . . 0.80000000000000004 112.872 -178.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.758 ' HG2' ' H ' ' A' ' 96' ' ' ASN . 0.1 OUTLIER -72.45 -28.74 63.13 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.73 -0.47 . . . . 4.9100000000000001 109.73 -179.354 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 77.5 mt -65.27 -38.52 82.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.76 -0.459 . . . . 1.1100000000000001 109.76 177.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.467 ' HA ' ' CD1' ' A' ' 104' ' ' PHE . 2.0 m -69.66 -34.69 62.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 116.134 -0.484 . . . . 2.0299999999999998 109.93 175.218 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.509 ' HB3' ' HE2' ' A' ' 57' ' ' PHE . . . -63.23 -49.34 74.52 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.558 0.694 . . . . 1.0600000000000001 110.078 175.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -55.13 -49.11 72.59 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.313 -1.312 . . . . 1.8400000000000001 111.715 -179.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.582 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 0.2 OUTLIER -77.27 -26.59 52.57 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.489 -0.484 . . . . 4.21 110.832 -176.336 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.681 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 29.2 t -73.55 -49.42 26.53 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.109 0.48 . . . . 1.55 110.197 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.536 ' HZ ' HD12 ' A' ' 72' ' ' LEU . 29.2 t80 -71.2 -24.89 62.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.893 -0.594 . . . . 3.6400000000000001 109.802 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.19 -43.25 81.1 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.804 -0.712 . . . . 0.32000000000000001 111.334 172.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.828 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.61 -32.41 84.08 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.77 -0.729 . . . . 0.23999999999999999 111.319 174.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.58 -30.02 61.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.827 0.346 . . . . 1.05 110.639 175.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.536 ' HB3' HD11 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.8 -41.18 97.96 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 107.988 -1.116 . . . . 1.78 107.988 -179.634 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.65 ' SG ' HG22 ' A' ' 123' ' ' VAL . 25.0 t -52.58 -54.55 31.47 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.468 -1.696 . . . . 0.90000000000000002 110.904 173.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.519 HG12 ' HG3' ' A' ' 20' ' ' LYS . 68.9 t -64.37 -41.25 91.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 1.2 111.588 -177.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.48 ' HB3' HG22 ' A' ' 74' ' ' ILE . 1.4 mm-40 -60.62 -25.03 65.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.035 0.445 . . . . 2.5099999999999998 110.746 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.435 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 50.6 m -77.14 -40.59 45.05 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 108.896 -0.779 . . . . 0.28000000000000003 108.896 174.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 111' ' ' CYS . 98.2 t -64.47 -35.42 74.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.095 -0.957 . . . . 1.8300000000000001 109.461 -179.613 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -50.17 -50.89 47.67 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 113.582 -1.645 . . . . 0.59999999999999998 111.129 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.439 ' CG ' ' HE2' ' A' ' 119' ' ' MET . 12.8 mmtp -87.2 14.1 8.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.703 -0.68 . . . . 2.1600000000000001 110.621 -179.188 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 66.1 38.34 4.8 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.443 0.639 . . . . 1.8799999999999999 110.308 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.439 ' HE2' ' CG ' ' A' ' 117' ' ' LYS . 24.7 mtm -117.71 50.16 1.16 Allowed 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.551 -0.907 . . . . 1.0800000000000001 108.551 -178.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.422 ' HA ' HG21 ' A' ' 123' ' ' VAL . 3.6 mt-30 -65.63 -7.1 13.35 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.725 -1.125 . . . . 1.1499999999999999 112.285 -176.116 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.551 HG22 HD22 ' A' ' 122' ' ' LEU . 30.0 m -68.04 -20.54 25.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.616 0.246 . . . . 1.1899999999999999 111.349 173.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.745 HD11 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -76.39 -27.18 56.25 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 110.216 -0.29 . . . . 1.0600000000000001 110.216 177.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.65 HG22 ' SG ' ' A' ' 111' ' ' CYS . 56.3 t -44.69 -53.15 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 O-C-N 123.986 0.804 . . . . 1.0 112.162 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.567 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 1.5 p -69.93 -39.42 76.14 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-O 120.86 0.362 . . . . 1.6599999999999999 111.587 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.745 ' HD2' HD11 ' A' ' 122' ' ' LEU . 92.2 mtt180 -62.15 -55.5 28.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.571 -0.74 . . . . 3.2999999999999998 110.183 -177.252 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.611 ' HA ' ' CE2' ' A' ' 129' ' ' TRP . 77.9 mt -51.93 -51.14 30.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.512 -0.767 . . . . 1.0600000000000001 111.177 -179.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.645 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.81 -25.57 63.29 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.804 0.298 . . . . 1.1000000000000001 111.804 -178.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.937 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -67.35 -63.88 0.97 Allowed 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.131 0.491 . . . . 1.1200000000000001 110.089 -178.34 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . 0.611 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 24.1 p-90 -78.1 -16.72 57.74 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 115.304 -0.862 . . . . 4.7699999999999996 112.059 -174.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.596 ' SD ' HG22 ' A' ' 126' ' ' ILE . 81.7 mtp -59.39 -54.35 47.77 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.144 -0.622 . . . . 1.0900000000000001 109.822 169.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.47 -38.29 77.67 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.763 -0.653 . . . . 1.05 110.689 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.584 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 56.7 m -60.92 -43.34 98.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 121.062 -0.255 . . . . 1.1299999999999999 111.378 175.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.467 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 82.7 t80 -59.71 -43.09 94.28 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.963 -0.384 . . . . 3.3500000000000001 109.963 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.668 HD13 ' HB2' ' A' ' 5' ' ' ASN . 5.4 tt -60.62 -47.62 85.42 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.734 -0.839 . . . . 1.5900000000000001 108.734 174.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . 0.416 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 2.8 m-80 -48.37 -58.59 4.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.663 -0.699 . . . . 0.46000000000000002 112.394 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -81.39 -45.56 15.92 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.197 0.443 . . . . 0.58999999999999997 112.197 -173.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . 0.467 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 1.6 m-70 -90.64 -50.14 6.09 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.744 0.646 . . . . 2.3399999999999999 112.744 -170.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.611 HD21 ' NH2' ' A' ' 99' ' ' ARG . 59.9 mt -89.33 -39.03 13.72 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 113.44 0.904 . . . . 1.8999999999999999 113.44 -165.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.637 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 32.1 tt0 -50.81 -52.45 57.01 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-O 119.134 -0.46 . . . . 0.75 112.098 -172.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.622 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.1 Cg_exo -53.85 -51.71 10.11 Favored 'Trans proline' 0 C--N 1.358 1.049 0 C-N-CA 121.772 1.648 . . . . 0.87 111.505 176.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . 0.467 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 8.4 t-105 -55.14 -51.9 64.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.186 -0.915 . . . . 1.4299999999999999 110.678 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.629 HD13 ' HA ' ' A' ' 139' ' ' GLU . 59.7 mt -46.85 -53.06 3.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.884 -0.598 . . . . 1.1299999999999999 111.654 172.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.637 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 76.3 mm-40 -62.18 -29.87 70.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.085 -0.507 . . . . 0.57999999999999996 111.675 -178.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.622 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 11.6 mm-40 -63.95 -20.57 65.97 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.611 0.72 . . . . 0.78000000000000003 110.437 175.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.657 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -104.1 0.94 30.28 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.072 -0.967 . . . . 0.93000000000000005 109.019 -175.487 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 124.8 -46.24 1.1 Allowed Glycine 0 N--CA 1.441 -1.028 0 CA-C-N 114.85 -1.068 . . . . 0.56000000000000005 112.299 178.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . 0.421 ' HA2' HG23 ' A' ' 142' ' ' ILE . . . 135.03 178.21 15.51 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.238 -0.745 . . . . 0.48999999999999999 111.238 -177.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.678 ' HB2' ' OE1' ' A' ' 42' ' ' GLU . 5.2 m-90 -63.5 -37.66 88.17 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 117.056 0.428 . . . . 4.5199999999999996 110.412 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.424 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 20.7 m-20 -52.85 -43.9 66.39 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.211 0.529 . . . . 1.96 110.203 176.243 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.569 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 89.2 m -60.24 -37.82 81.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.211 -0.904 . . . . 1.24 111.95 -175.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.427 ' CE2' HD11 ' A' ' 50' ' ' LEU . 84.7 t80 -62.97 -38.46 91.19 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.402 -0.519 . . . . 3.7200000000000002 109.989 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.584 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.5 m -74.67 -24.57 18.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.222 0.534 . . . . 1.8600000000000001 109.774 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 36.2 mm-40 -64.35 -25.49 68.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.201 0.524 . . . . 1.6699999999999999 110.081 173.042 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.0 mt -96.03 -57.42 2.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.697 -0.683 . . . . 1.96 110.476 178.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -120.36 28.82 7.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.561 -0.745 . . . . 4.3899999999999997 111.279 -170.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.72 ' HA2' ' HB3' ' A' ' 49' ' ' ALA . . . -60.94 167.69 10.84 Favored Glycine 0 CA--C 1.501 -0.817 0 CA-C-N 115.576 -0.738 . . . . 1.1000000000000001 113.258 179.257 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . 0.524 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 28.8 t-20 . . . . . 0 C--N 1.31 -1.145 0 CA-C-N 113.994 -1.103 . . . . 1.29 111.49 -178.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1005 ' ' GLY . . . . . 0.918 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.529 0.918 0 N-CA-C 113.416 0.126 . . . . 1.26 113.416 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -83.3 -56.86 3.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.003 0.43 . . . . 3.4500000000000002 111.133 174.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -67.83 -54.98 14.74 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.895 0.702 . . . . 1.54 112.895 -169.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.729 ' HG ' HG12 ' A' ' 86' ' ' VAL . 3.0 mm? -58.44 -53.64 56.01 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.227 0.329 . . . . 1.8999999999999999 110.965 -175.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 1.078 ' HB1' ' HB2' ' A' ' 89' ' ' GLU . . . -47.65 -45.74 28.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.701 0.762 . . . . 1.45 110.848 176.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -67.12 -54.45 21.23 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.303 -1.317 . . . . 1.51 111.406 -177.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -66.71 -17.1 64.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.516 . . . . 2.0699999999999998 110.528 179.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -83.94 -3.99 88.85 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.863 -0.608 . . . . 0.80000000000000004 113.467 -176.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -93.56 3.9 54.8 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.645 0.736 . . . . 1.8999999999999999 109.796 176.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 34.4 m . . . . . 0 C--N 1.327 -0.381 0 CA-C-N 115.668 -0.696 . . . . 1.4399999999999999 111.687 -175.263 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 . . . . . 0 C--O 1.233 0.188 0 CA-C-O 121.682 0.753 . . . . 2.7599999999999998 109.546 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.437 ' CB ' ' HG2' ' A' ' 42' ' ' GLU . 0.9 OUTLIER -72.78 -3.97 28.65 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.097 -0.956 . . . . 1.54 110.852 -178.427 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.541 ' HB2' ' HG ' ' A' ' 134' ' ' LEU . 3.3 p30 -62.97 -26.66 68.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.986 -0.552 . . . . 1.78 111.218 177.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.805 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.9 tpp180 -51.52 -49.87 61.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.05 -0.523 . . . . 1.8999999999999999 110.506 173.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.791 ' HB3' ' HE3' ' A' ' 47' ' ' LYS . 53.1 mt-10 -50.49 -52.74 35.56 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.964 -1.017 . . . . 0.68000000000000005 112.066 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.632 HD11 HG21 ' A' ' 46' ' ' VAL . 1.2 mp -50.71 -31.47 16.59 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.913 0.885 . . . . 1.8 112.094 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.448 HG22 ' N ' ' A' ' 131' ' ' ALA . 96.3 t -80.35 -60.35 2.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-O 121.48 0.657 . . . . 1.0700000000000001 110.023 174.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.578 HG22 ' O ' ' A' ' 6' ' ' ARG . 46.4 t -53.37 -54.2 19.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 114.79 -1.095 . . . . 1.1299999999999999 112.755 -174.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -57.25 -36.53 71.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.128 0.489 . . . . 0.58999999999999997 110.316 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.688 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -66.31 -53.54 35.33 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.633 -0.712 . . . . 2.02 109.985 179.246 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.999 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.7 mp -60.68 -38.5 85.15 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 120.699 0.285 . . . . 1.0600000000000001 110.827 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.505 ' HA ' ' CB ' ' A' ' 24' ' ' TRP . 27.0 t -60.67 -37.05 80.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.17 0.51 . . . . 1.6000000000000001 110.677 177.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -77.07 -23.81 51.92 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.975 -0.557 . . . . 1.49 110.252 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.769 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 8.8 mmpt? -81.67 -39.94 23.6 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.281 -0.418 . . . . 1.8400000000000001 111.648 -177.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.591 HD23 ' HA ' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -61.99 -27.84 69.15 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 119.926 -0.709 . . . . 1.98 110.183 176.294 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.7 t -75.04 -13.9 60.54 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.526 -0.761 . . . . 1.3799999999999999 111.337 -177.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.769 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 20.7 pt20 -81.01 -9.39 59.85 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.388 0.613 . . . . 1.51 111.883 -177.28 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.753 ' NZ ' HG12 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -120.02 -20.3 7.52 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 122.048 0.928 . . . . 2.6499999999999999 109.646 178.828 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.65 29.98 5.4 Favored Glycine 0 C--N 1.305 -1.18 0 CA-C-N 113.869 -1.514 . . . . 0.54000000000000004 112.799 175.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -109.82 169.69 8.55 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.715 0.293 . . . . 1.1200000000000001 110.909 168.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.5 t -105.27 150.19 25.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.153 0.501 . . . . 0.75 110.843 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.591 ' HA ' HD23 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -81.11 -43.79 18.91 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.346 -0.843 . . . . 4.29 110.032 172.88 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.435 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 7.0 p -71.21 -23.51 62.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.971 -0.559 . . . . 1.8600000000000001 111.564 -172.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -65.15 -27.26 68.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.902 0.382 . . . . 1.52 110.966 175.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -122.28 16.56 10.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.05 -0.523 . . . . 1.53 112.21 -174.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.435 ' OG ' ' HA ' ' A' ' 25' ' ' SER . 90.2 p -100.61 -179.23 4.03 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.88 0.696 . . . . 2.04 112.88 -172.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.546 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.9 t70 -168.59 -24.19 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.324 -1.307 . . . . 2.3100000000000001 109.806 178.716 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.665 HG23 ' H ' ' A' ' 31' ' ' GLU . 9.2 m -47.48 -70.95 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 114.912 -1.04 . . . . 1.4099999999999999 113.08 -171.646 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.665 ' H ' HG23 ' A' ' 30' ' ' VAL . 9.3 pt-20 -100.82 2.43 41.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.721 0.772 . . . . 2.7400000000000002 109.054 175.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.546 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 29.5 tt0 . . . . . 0 N--CA 1.448 -0.534 0 CA-C-N 114.624 -1.171 . . . . 1.45 111.127 -177.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.783 HG22 ' H ' ' A' ' 42' ' ' GLU . 1.5 t . . . . . 0 CA--C 1.54 0.575 0 N-CA-C 111.482 0.178 . . . . 1.45 111.482 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.783 ' H ' HG22 ' A' ' 41' ' ' THR . 11.9 pt-20 -94.56 -30.58 14.3 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-O 122.152 0.977 . . . . 2.02 110.376 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.804 ' HA ' HG13 ' A' ' 46' ' ' VAL . 58.5 m -75.66 -17.85 59.84 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.725 -1.58 . . . . 1.25 114.372 -166.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.588 ' HA ' ' CD ' ' A' ' 47' ' ' LYS . 39.4 tt0 -45.68 -47.02 15.09 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 118.237 0.471 . . . . 1.9099999999999999 111.113 -177.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.64 -46.03 64.06 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.721 0.267 . . . . 1.1799999999999999 111.721 175.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.804 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.9 m -67.1 -35.47 74.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 120.946 0.403 . . . . 2.0099999999999998 111.309 -175.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.791 ' HE3' ' HB3' ' A' ' 7' ' ' GLU . 6.8 ptmt -77.66 -32.29 53.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.963 -0.754 . . . . 1.3799999999999999 108.963 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.722 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -66.08 -30.47 70.99 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.719 -0.673 . . . . 0.98999999999999999 110.131 173.512 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.58 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -76.95 -42.66 38.3 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.233 0.54 . . . . 1.1399999999999999 111.077 176.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.55 HD21 ' HD2' ' A' ' 104' ' ' PHE . 1.3 tp -66.29 -25.1 66.7 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.621 -0.718 . . . . 1.95 112.486 -173.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.722 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.9 ptp180 -81.33 -28.42 34.55 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 109.069 -0.715 . . . . 2.5099999999999998 109.069 -175.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 10.8 mm-40 -74.2 -49.17 24.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.546 -1.206 . . . . 1.1000000000000001 109.38 176.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.65 -39.35 88.01 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.483 -0.78 . . . . 1.04 110.092 174.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.655 ' HA3' ' HZ ' ' A' ' 12' ' ' PHE . . . -63.91 -43.88 96.87 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.59 -0.732 . . . . 0.69999999999999996 112.047 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.597 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 32.6 t70 -58.14 -43.74 87.47 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.691 0.281 . . . . 1.04 110.256 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -58.19 -28.3 64.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.687 -0.688 . . . . 2.29 111.381 177.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -81.69 -44.54 16.98 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.919 -0.582 . . . . 2.9300000000000002 110.83 176.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.654 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 37.4 mt-10 -61.96 -63.2 1.33 Allowed 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.833 -0.621 . . . . 1.3 112.007 -172.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.691 HD13 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -48.9 -34.25 12.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.999 0.74 . . . . 2.1899999999999999 112.999 -173.738 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.691 ' H ' HD13 ' A' ' 59' ' ' LEU . 71.5 mtt-85 -62.88 -61.6 2.29 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.109 0.481 . . . . 3.1400000000000001 111.45 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -92.05 -3.61 55.55 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.827 -0.624 . . . . 5.5899999999999999 112.073 -173.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -49.93 -29.58 8.62 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 113.047 0.758 . . . . 4.9299999999999997 113.047 -175.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.9 mtp180 -54.32 -34.08 60.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.799 0.333 . . . . 5.3499999999999996 111.741 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.622 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -88.72 -26.6 21.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.491 -0.322 . . . . 1.7 111.418 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.597 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 39.0 t80 -46.83 -45.99 20.52 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.557 0.577 . . . . 3.52 112.557 -173.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.4 p -69.0 -24.92 64.28 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.848 0.356 . . . . 2.5899999999999999 111.629 -175.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -90.57 -29.77 17.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.482 -0.326 . . . . 2.7200000000000002 111.182 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.644 ' O ' HD13 ' A' ' 72' ' ' LEU . 18.8 mt -61.55 -22.77 65.46 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 112.589 0.589 . . . . 2.25 112.589 -173.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.618 HG23 HG13 ' A' ' 74' ' ' ILE . 15.8 p -58.68 -23.31 59.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 1.26 110.956 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 7.6 t -77.66 -38.99 46.49 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.903 -0.59 . . . . 1.8 109.64 176.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.51 ' NE2' HD22 ' A' ' 68' ' ' LEU . 12.4 mt-30 -65.15 -54.45 29.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.691 -0.686 . . . . 1.8899999999999999 109.837 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.644 HD13 ' O ' ' A' ' 68' ' ' LEU . 1.2 mp -66.36 -30.48 70.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.452 -0.794 . . . . 1.98 110.129 179.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 63.71 59.83 1.13 Allowed 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 122.167 0.984 . . . . 3.54 108.474 -175.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.636 HG21 ' HE1' ' A' ' 119' ' ' MET . 17.2 mm -57.82 122.96 8.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 113.789 -1.55 . . . . 1.1499999999999999 111.01 -178.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.753 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -157.34 -172.82 0.34 Allowed Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 108.021 -1.104 . . . . 1.1200000000000001 108.021 -168.825 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.753 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 34.9 Cg_exo -29.63 165.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 125.119 3.879 . . . . 0.53000000000000003 115.266 165.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.416 ' N ' HD13 ' A' ' 122' ' ' LEU . . . -29.56 -29.9 0.01 OUTLIER Glycine 0 N--CA 1.473 1.151 0 N-CA-C 117.33 1.692 . . . . 0.40999999999999998 117.33 -174.034 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 76' ' ' PRO . 39.4 p -71.66 11.08 0.54 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 117.79 0.795 . . . . 1.22 111.938 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.01 -13.17 61.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.246 0.546 . . . . 1.0700000000000001 109.736 172.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -78.79 -14.57 59.19 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.173 -0.677 . . . . 4.3099999999999996 109.173 175.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.41 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 53.5 mt-30 -84.52 -20.87 30.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.828 0.823 . . . . 1.03 109.917 172.612 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.579 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 6.5 m -80.02 -48.64 12.99 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 114.575 -1.193 . . . . 0.47999999999999998 108.828 169.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -62.75 -17.43 60.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.887 -1.051 . . . . 1.4399999999999999 109.915 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.629 ' HA ' HG12 ' A' ' 87' ' ' VAL . 34.7 tt0 -60.49 -50.44 73.53 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.458 -0.792 . . . . 0.80000000000000004 110.579 177.437 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -47.47 -35.14 8.22 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.01 -0.995 . . . . 1.99 110.702 176.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.632 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.6 t -81.83 -51.38 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.978 0 CA-C-N 114.485 -1.234 . . . . 1.8999999999999999 110.7 -177.111 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.629 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.8 p -61.58 -23.9 32.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-O 121.554 0.692 . . . . 1.4299999999999999 109.731 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.432 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.8 m-80 -71.99 -40.74 68.34 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.402 -1.272 . . . . 0.91000000000000003 111.977 176.433 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 1.05 ' HB2' ' HB1' ' B' 1009 ' ' ALA . 1.3 pp20? -73.23 -29.43 62.78 Favored 'General case' 0 CA--C 1.495 -1.149 0 CA-C-O 121.699 0.761 . . . . 2.8700000000000001 109.127 177.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.497 HD11 ' OE2' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -71.05 -32.52 69.27 Favored 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.556 -1.202 . . . . 1.9199999999999999 111.619 -168.158 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.404 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 2.3 p90 -107.47 11.69 28.59 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.108 0.48 . . . . 2.9700000000000002 110.859 -172.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.9 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -54.42 -34.53 61.53 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.685 -0.689 . . . . 5.6699999999999999 112.553 -177.789 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.935 ' HB3' HD22 ' A' ' 96' ' ' ASN . 15.4 t70 -84.48 -18.76 34.8 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 122.101 0.953 . . . . 3.1200000000000001 110.239 176.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.832 ' O ' HG23 ' A' ' 95' ' ' VAL . . . 130.95 -40.0 1.71 Allowed Glycine 0 N--CA 1.44 -1.037 0 CA-C-N 114.234 -1.348 . . . . 2.3100000000000001 110.918 173.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.832 HG23 ' O ' ' A' ' 94' ' ' GLY . 2.9 t 173.36 110.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.349 0.566 0 C-N-CA 127.022 2.129 . . . . 1.6799999999999999 108.15 160.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.935 HD22 ' HB3' ' A' ' 93' ' ' ASP . 1.1 m120 -83.91 152.83 24.3 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.753 -0.462 . . . . 2.1200000000000001 109.753 -177.023 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.537 ' HH2' ' HB2' ' A' ' 155' ' ' TYR . 84.9 t90 -59.04 -52.84 64.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.272 0.558 . . . . 4.1200000000000001 110.111 178.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -77.41 -16.34 80.5 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.646 -0.706 . . . . 0.80000000000000004 112.698 -177.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.804 ' HB3' ' HB2' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -72.51 -29.26 63.45 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.535 -0.542 . . . . 4.9100000000000001 109.535 -179.635 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 33.0 mt -63.3 -45.11 99.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 109.394 -0.595 . . . . 1.1100000000000001 109.394 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.8 m -62.6 -39.33 84.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.827 -0.624 . . . . 2.0299999999999998 109.648 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.24 -44.86 94.02 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 121.087 0.47 . . . . 1.0600000000000001 111.04 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -58.66 -42.06 87.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.289 -0.869 . . . . 1.8400000000000001 110.956 -179.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.653 ' HZ ' ' HB2' ' A' ' 134' ' ' LEU . 28.9 m-85 -80.63 -30.18 36.71 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.671 0.272 . . . . 4.21 111.145 179.229 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.58 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 48.0 t -63.65 -56.23 17.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.153 -0.476 . . . . 1.55 110.222 176.003 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.485 ' HZ ' HD11 ' A' ' 72' ' ' LEU . 32.7 t80 -74.31 -26.34 60.11 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.928 -0.578 . . . . 3.6400000000000001 110.364 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.99 -45.59 86.68 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.336 -0.935 . . . . 0.32000000000000001 111.016 173.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.999 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.5 -29.42 74.78 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 111.11 -0.796 . . . . 0.23999999999999999 111.11 174.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.597 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -71.51 -34.54 70.19 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.983 -0.377 . . . . 1.05 109.983 176.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.469 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.3 OUTLIER -67.55 -34.88 77.97 Favored 'General case' 0 CA--C 1.506 -0.741 0 CA-C-O 121.892 0.853 . . . . 1.78 109.781 -179.267 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.755 ' HG ' HG11 ' A' ' 123' ' ' VAL . 44.2 t -51.25 -50.73 58.65 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.295 -1.321 . . . . 0.90000000000000002 109.271 170.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.753 HG12 ' NZ ' ' A' ' 20' ' ' LYS . 86.3 t -63.84 -38.19 81.69 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 CA-C-N 116.252 -0.431 . . . . 1.2 110.514 175.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.469 ' OE2' ' HA ' ' A' ' 110' ' ' LEU . 42.8 mt-10 -56.12 -33.19 64.91 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.977 0.418 . . . . 2.5099999999999998 110.552 176.168 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.534 ' HA ' ' HE2' ' A' ' 119' ' ' MET . 25.1 m -79.73 -41.65 26.24 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.006 -0.543 . . . . 0.28000000000000003 109.557 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.685 HG21 ' O ' ' A' ' 111' ' ' CYS . 99.3 t -68.74 -31.01 49.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.827 0.822 . . . . 1.8300000000000001 109.739 -175.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -55.61 -47.9 75.8 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.015 -1.448 . . . . 0.59999999999999998 110.858 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.445 ' CG ' ' HE3' ' A' ' 119' ' ' MET . 23.8 mmtt -90.2 14.42 12.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.678 -0.692 . . . . 2.1600000000000001 110.325 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 62.25 43.78 8.16 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.74 0.781 . . . . 1.8799999999999999 111.278 -179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.636 ' HE1' HG21 ' A' ' 74' ' ' ILE . 32.8 mtm -115.96 49.33 1.12 Allowed 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.645 -1.242 . . . . 1.0800000000000001 107.645 178.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -67.85 -6.72 22.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.182 -1.372 . . . . 1.1499999999999999 112.455 -171.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.472 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 27.0 m -72.52 -12.79 16.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.935 0.398 . . . . 1.1899999999999999 111.211 175.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.703 HD11 ' HD3' ' A' ' 125' ' ' ARG . 2.9 mm? -83.62 -24.09 31.58 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 109.776 -0.453 . . . . 1.0600000000000001 109.776 176.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.755 HG11 ' HG ' ' A' ' 111' ' ' CYS . 67.4 t -46.9 -55.58 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.783 -0.644 . . . . 1.0 112.223 -178.31 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 12.8 t -73.88 -31.41 63.13 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.729 -0.388 . . . . 1.6599999999999999 110.142 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.703 ' HD3' HD11 ' A' ' 122' ' ' LEU . 11.8 mtp180 -61.23 -58.66 7.37 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 120.859 0.362 . . . . 3.2999999999999998 110.639 178.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.65 HG22 ' SD ' ' A' ' 130' ' ' MET . 71.2 mt -51.77 -52.62 21.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.545 -0.752 . . . . 1.0600000000000001 110.043 179.257 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.806 ' HB3' HD21 ' A' ' 13' ' ' LEU . . . -56.19 -36.31 68.23 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.945 0.402 . . . . 1.1000000000000001 111.627 179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.805 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -63.59 -59.64 4.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.219 0.533 . . . . 1.1200000000000001 110.499 176.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 68.7 m95 -67.36 -22.74 65.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.887 -1.051 . . . . 4.7699999999999996 111.504 -174.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.65 ' SD ' HG22 ' A' ' 126' ' ' ILE . 85.9 mtp -69.24 -54.11 16.44 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.679 0.276 . . . . 1.0900000000000001 111.244 175.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.448 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -67.11 -33.17 74.89 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.506 -0.316 . . . . 1.05 110.844 -177.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 97.6 m -63.8 -45.14 91.04 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.672 -0.411 . . . . 1.1299999999999999 110.884 175.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -57.91 -41.97 83.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.034 0.445 . . . . 3.3500000000000001 110.04 176.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.925 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.5 OUTLIER -57.38 -58.11 9.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.728 -0.669 . . . . 1.5900000000000001 109.663 172.242 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -45.22 -55.28 5.98 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.036 -0.984 . . . . 0.46000000000000002 112.631 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -76.21 -53.33 8.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.994 0.426 . . . . 0.58999999999999997 111.853 -173.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.79 -50.27 5.83 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.774 0.657 . . . . 2.3399999999999999 112.774 -169.241 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.925 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -76.55 -47.35 22.88 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 113.629 0.974 . . . . 1.8999999999999999 113.629 -167.453 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.589 ' HA ' HD11 ' A' ' 142' ' ' ILE . 18.7 tt0 -45.24 -52.36 21.4 Favored Pre-proline 0 CA--C 1.538 0.511 0 O-C-N 123.965 0.791 . . . . 0.75 112.785 -170.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.532 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 31.3 Cg_exo -58.52 -45.21 31.52 Favored 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 121.704 1.603 . . . . 0.87 111.689 178.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . 0.634 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.8 OUTLIER -58.78 -52.07 67.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.174 -0.921 . . . . 1.4299999999999999 110.846 179.137 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.596 HD13 ' NE1' ' A' ' 148' ' ' TRP . 59.1 mt -45.62 -52.52 2.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.661 -0.7 . . . . 1.1299999999999999 111.768 175.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.556 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.7 mm-40 -58.32 -34.44 70.6 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.812 -0.631 . . . . 0.57999999999999996 111.34 -179.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 10.8 mm-40 -64.03 -22.9 67.12 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.118 0.485 . . . . 0.78000000000000003 111.103 177.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.637 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -100.9 -7.45 23.45 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.655 -0.702 . . . . 0.93000000000000005 109.575 -173.554 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 134.99 -36.96 2.0 Allowed Glycine 0 N--CA 1.44 -1.034 0 CA-C-N 115.358 -0.837 . . . . 0.56000000000000005 112.772 176.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 120.16 175.22 15.55 Favored Glycine 0 N--CA 1.449 -0.44 0 N-CA-C 111.146 -0.781 . . . . 0.48999999999999999 111.146 -175.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.596 ' NE1' HD13 ' A' ' 142' ' ' ILE . 4.8 m-90 -67.48 -33.72 75.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.339 0.569 . . . . 4.5199999999999996 111.319 -176.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.405 ' O ' ' HG3' ' A' ' 153' ' ' GLU . 9.7 m-20 -58.98 -40.06 83.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.119 0.485 . . . . 1.96 110.233 177.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.535 ' O ' ' HB2' ' A' ' 153' ' ' GLU . 55.3 m -55.54 -37.33 67.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.392 -0.822 . . . . 1.24 112.224 177.393 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.415 ' HA ' ' HZ2' ' A' ' 97' ' ' TRP . 10.5 m-85 -61.47 -39.84 92.36 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.459 -0.497 . . . . 3.7200000000000002 110.356 -178.652 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.753 HG12 ' HA ' ' A' ' 46' ' ' VAL . 0.8 OUTLIER -75.42 -26.11 18.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.074 -0.512 . . . . 1.8600000000000001 110.004 177.764 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.535 ' HB2' ' O ' ' A' ' 150' ' ' THR . 70.2 mt-10 -58.08 -30.35 66.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.243 -0.435 . . . . 1.6699999999999999 110.483 171.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.507 HD11 ' CE2' ' A' ' 97' ' ' TRP . 3.4 mt -98.65 -56.7 2.38 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.23 -0.441 . . . . 1.96 111.023 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . 0.537 ' HB2' ' HH2' ' A' ' 97' ' ' TRP . 3.1 m-85 -120.59 28.47 7.96 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.174 -0.466 . . . . 4.3899999999999997 111.098 -173.528 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.58 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -62.9 157.49 38.9 Favored Glycine 0 CA--C 1.498 -0.997 0 C-N-CA 120.654 -0.784 . . . . 1.1000000000000001 112.699 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . 0.576 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 20.1 t-20 . . . . . 0 C--N 1.308 -1.197 0 CA-C-N 114.286 -0.957 . . . . 1.29 109.449 174.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1005 ' ' GLY . . . . . 1.015 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.534 1.223 0 N-CA-C 113.588 0.195 . . . . 1.26 113.588 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -86.23 -52.32 5.72 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.462 -0.434 . . . . 3.4500000000000002 111.344 171.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -71.38 -55.02 8.79 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 113.012 0.745 . . . . 1.54 113.012 -170.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.491 ' HG ' HG13 ' A' ' 86' ' ' VAL . 3.3 mm? -59.75 -56.52 20.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.584 -0.28 . . . . 1.8999999999999999 110.679 -177.484 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 1.05 ' HB1' ' HB2' ' A' ' 89' ' ' GLU . . . -41.18 -48.83 3.51 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.899 0.749 . . . . 1.45 111.578 173.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -65.19 -55.22 19.82 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 114.427 -1.26 . . . . 1.51 111.786 -177.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -66.05 -24.92 66.83 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.024 0.44 . . . . 2.0699999999999998 110.945 -178.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.44 -5.27 72.17 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.807 -0.633 . . . . 0.80000000000000004 113.07 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 21.7 t70 -80.3 -20.73 43.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.264 0.554 . . . . 1.8999999999999999 110.114 175.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 9.7 m . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 115.89 -0.595 . . . . 1.4399999999999999 112.121 -172.33 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 70.4 mm-40 . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.847 0.356 . . . . 2.7599999999999998 111.141 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.8 p -66.55 -18.99 65.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.107 -0.497 . . . . 1.54 111.473 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.651 ' HB3' ' HG ' ' A' ' 134' ' ' LEU . 72.7 m-20 -64.27 -23.92 67.48 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.072 0.463 . . . . 1.78 110.19 176.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.935 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.2 tpp180 -56.88 -55.49 33.78 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.512 -0.767 . . . . 1.8999999999999999 110.143 175.336 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.642 ' HB3' ' CE ' ' A' ' 47' ' ' LYS . 43.8 mt-10 -53.58 -49.93 66.69 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.409 -1.269 . . . . 0.68000000000000005 111.434 -177.293 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.65 HD21 ' HA ' ' A' ' 5' ' ' ASN . 0.4 OUTLIER -51.91 -33.96 39.38 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.963 -1.017 . . . . 1.8 112.12 178.531 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.576 HG22 ' HE1' ' A' ' 104' ' ' PHE . 64.5 t -78.6 -59.35 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.719 0.771 . . . . 1.0700000000000001 109.485 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.492 HG13 ' CE2' ' A' ' 24' ' ' TRP . 73.3 t -48.32 -57.32 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 114.223 -1.353 . . . . 1.1299999999999999 113.099 -176.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -59.03 -31.77 69.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.698 0.285 . . . . 0.58999999999999997 110.721 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.606 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.6 t80 -75.97 -44.62 38.94 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 116.265 -0.425 . . . . 2.02 110.444 -179.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.892 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.3 mp -60.43 -42.29 95.76 Favored 'General case' 0 CA--C 1.52 -0.185 0 C-N-CA 120.377 -0.529 . . . . 1.0600000000000001 110.363 176.465 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.8 t -62.13 -40.2 95.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.097 -0.501 . . . . 1.6000000000000001 109.89 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -59.71 -29.84 68.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.601 -0.727 . . . . 1.49 110.769 178.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.542 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 17.4 mmmt -78.6 -50.62 11.19 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.558 0.694 . . . . 1.8400000000000001 110.506 -179.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.599 HD22 ' SG ' ' A' ' 111' ' ' CYS . 12.5 mt -56.52 -28.03 58.94 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 115.444 -0.798 . . . . 1.98 111.853 176.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.7 m -56.29 -44.67 80.06 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 112.362 0.504 . . . . 1.3799999999999999 112.362 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.542 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 14.8 pt20 -75.46 0.12 18.23 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.31 0.576 . . . . 1.51 111.368 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.514 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.6 mmmt -109.53 -30.08 8.1 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.769 0.795 . . . . 2.6499999999999999 109.199 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.99 24.06 9.35 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 114.134 -1.394 . . . . 0.54000000000000004 111.139 178.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -115.2 160.5 19.65 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.079 0.466 . . . . 1.1200000000000001 111.23 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.7 t -101.17 147.65 26.0 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.391 -0.822 . . . . 0.75 109.628 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.492 ' CE2' HG13 ' A' ' 10' ' ' VAL . 0.5 OUTLIER -79.31 -44.53 21.45 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.355 -0.609 . . . . 4.29 109.355 173.773 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.432 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 6.3 p -64.65 -32.94 74.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.384 -0.826 . . . . 1.8600000000000001 111.76 -172.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -59.62 -24.29 63.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.136 0.493 . . . . 1.52 111.698 178.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.554 ' O ' ' HB2' ' A' ' 124' ' ' SER . 22.2 m-85 -120.46 13.57 11.82 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.898 -0.592 . . . . 1.53 110.897 -175.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.558 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 60.3 p -101.11 -178.53 3.77 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.923 0.712 . . . . 2.04 112.923 -170.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.604 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 4.2 t70 -170.54 -26.93 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.324 -1.307 . . . . 2.3100000000000001 109.359 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.65 HG21 ' H ' ' A' ' 31' ' ' GLU . 10.7 m -45.16 -70.68 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-N 114.424 -1.262 . . . . 1.4099999999999999 113.075 -173.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.65 ' H ' HG21 ' A' ' 30' ' ' VAL . 7.9 pt-20 -100.79 2.28 41.06 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.179 -0.675 . . . . 2.7400000000000002 109.179 176.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.604 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.7 tt0 . . . . . 0 N--CA 1.45 -0.433 0 CA-C-N 114.798 -1.092 . . . . 1.45 111.38 -175.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.873 HG22 ' H ' ' A' ' 42' ' ' GLU . 1.6 t . . . . . 0 CA--C 1.536 0.424 0 CA-C-O 120.831 0.348 . . . . 1.45 110.313 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.873 ' H ' HG22 ' A' ' 41' ' ' THR . 3.6 pt-20 -94.15 -28.87 15.44 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.281 1.039 . . . . 2.02 108.48 167.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.424 ' C ' ' HD2' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -56.34 -38.52 71.47 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 112.829 -1.987 . . . . 1.25 113.686 -169.826 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.519 ' HA ' ' CD ' ' A' ' 47' ' ' LYS . 13.8 tp10 -47.9 -56.1 8.33 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 117.903 0.319 . . . . 1.9099999999999999 110.757 -174.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.506 ' HB2' HG21 ' A' ' 152' ' ' VAL . . . -66.14 -40.19 90.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.833 0.349 . . . . 1.1799999999999999 110.743 178.096 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.711 ' HA ' HG13 ' A' ' 152' ' ' VAL . 84.8 t -56.75 -59.94 2.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.572 0.701 . . . . 2.0099999999999998 111.134 178.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.642 ' CE ' ' HB3' ' A' ' 7' ' ' GLU . 4.2 ptmt -64.53 -30.77 71.8 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.811 -1.086 . . . . 1.3799999999999999 109.837 -176.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.749 ' HB3' ' HB3' ' A' ' 157' ' ' ASN . 8.2 mm100 -72.91 -27.35 61.81 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.566 -0.743 . . . . 0.98999999999999999 110.882 177.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.611 ' HB1' ' HA2' ' A' ' 156' ' ' GLY . . . -79.7 -34.61 40.03 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.127 0.489 . . . . 1.1399999999999999 109.814 175.254 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mp -62.73 -35.8 80.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.339 -0.846 . . . . 1.95 112.218 -178.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.545 ' HD3' ' NE2' ' A' ' 48' ' ' GLN . 11.6 ptm180 -68.99 -36.23 77.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.713 0.768 . . . . 2.5099999999999998 109.585 178.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.546 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 6.6 mt-10 -80.74 -37.29 30.75 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.874 -1.057 . . . . 1.1000000000000001 110.811 -174.198 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.42 -34.77 72.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.742 -0.663 . . . . 1.04 109.667 171.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.57 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.92 -50.69 61.55 Favored Glycine 0 C--O 1.223 -0.593 0 CA-C-N 115.342 -0.844 . . . . 0.69999999999999996 112.431 179.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.625 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 28.1 t70 -54.29 -36.36 63.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.24 0.543 . . . . 1.04 111.099 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.47 ' O ' HD13 ' A' ' 59' ' ' LEU . 4.3 tt0 -76.98 -27.6 54.79 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.422 -0.808 . . . . 2.29 110.867 -178.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.475 ' CE1' ' HA2' ' B' 1012 ' ' GLY . 0.1 OUTLIER -82.87 -54.12 5.34 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.773 -0.649 . . . . 2.9300000000000002 111.791 178.965 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.595 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 17.2 mt-10 -55.39 -54.5 42.91 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.975 0.731 . . . . 1.3 112.975 -168.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.689 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -42.48 -41.31 2.9 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.739 1.014 . . . . 2.1899999999999999 113.739 -172.862 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.689 ' H ' HD12 ' A' ' 59' ' ' LEU . 36.4 mtm180 -59.41 -59.45 5.42 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 111.939 0.348 . . . . 3.1400000000000001 111.939 -176.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.595 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -91.77 -5.67 53.14 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.052 0.76 . . . . 5.5899999999999999 113.052 -175.352 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.449 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 24.6 ptt180 -66.42 -15.09 63.05 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 122.246 -0.284 . . . . 4.9299999999999997 111.539 -175.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 63' ' ' ARG . 37.7 mtm105 -67.87 -15.95 63.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.243 -0.435 . . . . 5.3499999999999996 111.438 179.336 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.735 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.38 -35.06 13.91 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.585 0.217 . . . . 1.7 111.585 175.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.647 ' HE1' HD12 ' B' 1008 ' ' LEU . 9.6 m-30 -43.32 -50.53 6.63 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.141 1.163 . . . . 3.52 114.141 -168.064 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.6 m -72.79 -20.53 61.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.101 0.477 . . . . 2.5899999999999999 111.41 -171.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -90.41 -23.98 20.89 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.785 -0.643 . . . . 2.7200000000000002 110.297 178.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.735 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 70.1 mt -77.65 -16.06 58.78 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 113.012 0.745 . . . . 2.25 113.012 -173.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.55 HG21 HG13 ' A' ' 74' ' ' ILE . 3.5 p -56.15 -28.9 59.78 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.27 0.47 . . . . 1.26 112.27 -172.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.2 t -67.37 -36.62 81.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.39 0.614 . . . . 1.8 109.823 175.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.624 ' NE2' HD23 ' A' ' 68' ' ' LEU . 17.1 mt-30 -72.43 -41.59 66.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.321 -0.854 . . . . 1.8899999999999999 109.765 177.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 73' ' ' HIS . 3.5 mm? -65.71 -32.2 73.61 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.05 -0.523 . . . . 1.98 110.921 176.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.427 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 38.6 m80 63.9 40.44 7.41 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.887 -0.783 . . . . 3.54 108.887 -173.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.574 HG23 ' HB3' ' A' ' 113' ' ' GLU . 35.9 mm -49.62 113.74 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-N 114.447 -1.251 . . . . 1.1499999999999999 111.441 -178.198 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.776 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.81 -170.37 0.24 Allowed Pre-proline 0 CA--C 1.548 0.887 0 N-CA-C 107.922 -1.14 . . . . 1.1200000000000001 107.922 -168.633 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.776 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.3 Cg_exo -28.71 166.88 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.089 1 C-N-CA 125.407 4.072 . . . . 0.53000000000000003 115.537 162.857 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.87 -29.18 0.01 OUTLIER Glycine 0 N--CA 1.472 1.053 0 N-CA-C 117.261 1.664 . . . . 0.40999999999999998 117.261 -173.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' A' ' 81' ' ' GLN . 32.9 p -68.51 3.36 1.84 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 117.93 0.865 . . . . 1.22 111.997 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.64 -13.39 61.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.339 0.59 . . . . 1.0700000000000001 109.564 170.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.419 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 50.2 t80 -75.45 -18.43 59.88 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 115.703 -0.68 . . . . 4.3099999999999996 109.234 173.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.502 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 74.2 mt-30 -80.42 -26.99 38.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 122.199 1.0 . . . . 1.03 109.416 172.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m -78.09 -33.05 50.93 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.188 -1.369 . . . . 0.47999999999999998 110.039 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.667 ' HB2' ' HG ' ' A' ' 110' ' ' LEU . 67.7 t80 -80.42 -17.07 52.89 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.583 0.706 . . . . 1.4399999999999999 109.378 172.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.553 ' HA ' HG11 ' A' ' 87' ' ' VAL . 35.3 tt0 -68.2 -57.99 5.14 Favored 'General case' 0 CA--C 1.498 -1.054 0 CA-C-N 115.109 -0.95 . . . . 0.80000000000000004 111.178 -174.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.592 ' HG3' ' H ' ' A' ' 86' ' ' VAL . 3.2 pt20 -43.95 -38.88 3.69 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 113.557 -1.656 . . . . 1.99 110.932 178.236 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.592 ' H ' ' HG3' ' A' ' 85' ' ' GLN . 1.5 t -78.28 -53.94 13.11 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.734 0 CA-C-N 112.465 -2.152 . . . . 1.8999999999999999 111.142 -177.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.553 HG11 ' HA ' ' A' ' 84' ' ' GLU . 8.6 p -60.73 -21.61 24.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 122.057 0.932 . . . . 1.4299999999999999 109.445 -178.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.454 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 2.7 m-80 -70.96 -43.77 67.42 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 113.897 -1.501 . . . . 0.91000000000000003 111.34 173.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.682 ' OE1' ' HA ' ' B' 1009 ' ' ALA . 2.0 pp20? -73.01 -37.56 66.92 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 121.767 0.794 . . . . 2.8700000000000001 109.055 177.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.885 HD13 HH11 ' A' ' 99' ' ' ARG . 3.5 tp -66.74 -19.82 65.83 Favored 'General case' 0 N--CA 1.433 -1.31 0 CA-C-N 113.731 -1.577 . . . . 1.9199999999999999 112.015 -165.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.639 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 2.6 p90 -110.64 -28.82 8.29 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 120.524 -0.471 . . . . 2.9700000000000002 112.0 -173.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.518 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 9.9 ptm180 -72.94 -39.31 66.33 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.289 0.566 . . . . 5.6699999999999999 111.534 -171.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -88.93 13.44 12.76 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.269 -0.878 . . . . 3.1200000000000001 113.361 -169.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.573 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 128.46 70.66 0.14 Allowed Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 116.952 -2.547 . . . . 2.3100000000000001 115.459 178.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.639 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 75.0 t -72.06 104.48 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 118.417 1.109 . . . . 1.6799999999999999 111.066 178.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -111.24 -170.22 1.6 Allowed 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.224 -1.353 . . . . 2.1200000000000001 108.712 177.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 10.8 m-90 -56.1 -46.35 79.11 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 123.515 0.509 . . . . 4.1200000000000001 111.192 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -79.05 -30.62 46.13 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.957 -0.64 . . . . 0.80000000000000004 113.938 -175.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.885 HH11 HD13 ' A' ' 90' ' ' LEU . 16.6 mmt180 -55.61 -42.44 74.89 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 117.216 0.508 . . . . 4.9100000000000001 111.553 -178.03 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.563 HG21 ' CE2' ' A' ' 104' ' ' PHE . 55.0 mt -67.8 -38.57 80.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.969 -0.56 . . . . 1.1100000000000001 110.678 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 52.0 t -53.97 -54.18 22.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.937 -0.574 . . . . 2.0299999999999998 110.033 172.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.68 -40.62 72.56 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.503 -0.772 . . . . 1.0600000000000001 111.227 177.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -58.9 -40.96 86.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.372 -0.831 . . . . 1.8400000000000001 111.069 177.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.576 ' HE1' HG22 ' A' ' 9' ' ' VAL . 39.1 m-85 -71.11 -34.09 70.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.694 0.283 . . . . 4.21 110.506 175.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.606 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 25.3 t -58.95 -57.49 12.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.078 -0.51 . . . . 1.55 111.127 178.165 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.494 ' CE2' HG21 ' A' ' 86' ' ' VAL . 34.6 t80 -68.11 -31.89 71.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 3.6400000000000001 110.231 -178.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.48 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -67.3 -46.21 73.09 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.786 -0.721 . . . . 0.32000000000000001 111.785 177.208 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.892 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.56 -31.98 81.84 Favored Glycine 0 N--CA 1.441 -0.982 0 C-N-CA 120.646 -0.787 . . . . 0.23999999999999999 111.148 176.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.45 -30.56 67.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.577 -0.311 . . . . 1.05 110.526 175.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.667 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -65.02 -42.54 94.3 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 107.974 -1.121 . . . . 1.78 107.974 178.795 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.7 ' SG ' HG21 ' A' ' 123' ' ' VAL . 38.2 t -52.74 -54.8 28.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.101 -1.409 . . . . 0.90000000000000002 110.479 172.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.514 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 73.8 t -62.97 -42.78 97.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.202 -0.453 . . . . 1.2 111.864 -177.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.574 ' HB3' HG23 ' A' ' 74' ' ' ILE . 3.4 mm-40 -59.08 -29.13 67.11 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.606 -0.438 . . . . 2.5099999999999998 110.991 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.433 ' HA ' ' HE3' ' A' ' 119' ' ' MET . 47.7 m -73.31 -39.23 65.45 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.963 -0.754 . . . . 0.28000000000000003 108.963 176.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.622 HG21 ' O ' ' A' ' 111' ' ' CYS . 80.5 t -67.07 -38.13 80.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.213 -0.903 . . . . 1.8300000000000001 109.397 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -52.75 -50.44 63.48 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 113.364 -1.744 . . . . 0.59999999999999998 111.338 -179.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.472 ' HZ1' HG22 ' A' ' 69' ' ' THR . 20.7 mmtt -88.18 16.18 6.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.137 -0.483 . . . . 2.1600000000000001 110.394 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.495 ' HA ' ' NE2' ' A' ' 120' ' ' GLN . 45.5 mt-10 63.87 49.32 2.89 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.82 0.819 . . . . 1.8799999999999999 110.729 178.276 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.506 ' HE2' HG22 ' A' ' 74' ' ' ILE . 26.4 mtm -130.67 44.69 2.92 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.627 -1.17 . . . . 1.0800000000000001 108.203 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.612 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 3.4 mp0 -62.45 -6.99 3.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.283 -0.871 . . . . 1.1499999999999999 112.958 -173.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.572 HG23 HD23 ' A' ' 122' ' ' LEU . 26.6 m -66.01 -21.85 29.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 O-C-N 122.14 -0.35 . . . . 1.1899999999999999 111.577 176.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.68 HD12 ' HD3' ' A' ' 125' ' ' ARG . 3.3 mm? -75.53 -25.24 57.02 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 110.291 -0.263 . . . . 1.0600000000000001 110.291 178.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.7 HG21 ' SG ' ' A' ' 111' ' ' CYS . 49.6 t -43.86 -53.63 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 123.917 0.761 . . . . 1.0 112.059 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.558 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 12.6 t -71.99 -37.77 69.8 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.853 -0.339 . . . . 1.6599999999999999 110.718 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.68 ' HD3' HD12 ' A' ' 122' ' ' LEU . 63.7 mtp180 -61.0 -56.52 20.11 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.305 -0.407 . . . . 3.2999999999999998 110.512 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.582 HG21 ' SD ' ' A' ' 130' ' ' MET . 70.7 mt -52.25 -50.67 36.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.807 -0.633 . . . . 1.0600000000000001 110.305 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.789 ' HB1' HD21 ' A' ' 13' ' ' LEU . . . -57.18 -36.17 70.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.851 0.358 . . . . 1.1000000000000001 111.378 179.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.935 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -63.54 -57.69 9.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.311 0.577 . . . . 1.1200000000000001 110.556 176.137 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -66.72 -26.9 67.23 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.719 -1.128 . . . . 4.7699999999999996 111.197 -174.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.582 ' SD ' HG21 ' A' ' 126' ' ' ILE . 89.7 mtp -69.23 -53.99 17.05 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.081 0.467 . . . . 1.0900000000000001 110.972 175.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.481 ' CA ' HG23 ' A' ' 9' ' ' VAL . . . -59.33 -39.26 82.59 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.8 -0.636 . . . . 1.05 111.073 -178.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 86.7 m -63.56 -47.32 82.04 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.763 -0.375 . . . . 1.1299999999999999 111.022 176.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.581 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 12.1 t80 -55.43 -39.35 70.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.178 0.514 . . . . 3.3500000000000001 109.847 178.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.848 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.3 OUTLIER -59.91 -60.71 3.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.821 -0.627 . . . . 1.5900000000000001 109.855 170.833 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -45.94 -44.36 14.72 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.054 -0.975 . . . . 0.46000000000000002 113.245 -179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -86.14 -51.87 6.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.989 0.423 . . . . 0.58999999999999997 112.047 -178.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . 0.581 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 8.7 m80 -89.54 -49.7 6.52 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.889 0.7 . . . . 2.3399999999999999 112.889 -168.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.848 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -76.71 -44.82 31.94 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 113.0 0.741 . . . . 1.8999999999999999 113.0 -169.906 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.616 ' HA ' HD11 ' A' ' 142' ' ' ILE . 17.6 tt0 -42.23 -53.57 8.6 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.106 -0.952 . . . . 0.75 113.254 -171.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.534 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 24.3 Cg_exo -63.11 -42.55 22.76 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 121.76 1.64 . . . . 0.87 111.634 178.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . 0.493 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -56.8 -48.71 77.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.283 -0.871 . . . . 1.4299999999999999 110.421 177.514 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.616 HD11 ' HA ' ' A' ' 139' ' ' GLU . 42.6 mt -49.76 -49.71 19.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.266 -0.879 . . . . 1.1299999999999999 111.455 175.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.549 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.5 mm-40 -58.86 -32.64 69.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.543 -0.753 . . . . 0.57999999999999996 111.355 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.1 mm-40 -66.42 -19.45 65.8 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.304 0.574 . . . . 0.78000000000000003 111.1 176.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.608 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -108.0 3.25 23.86 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.469 -0.787 . . . . 0.93000000000000005 109.522 -175.759 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.32 -49.17 0.89 Allowed Glycine 0 N--CA 1.44 -1.081 0 CA-C-N 115.156 -0.929 . . . . 0.56000000000000005 112.764 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . 0.435 ' O ' ' HB ' ' A' ' 150' ' ' THR . . . 139.66 178.95 17.19 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.765 -0.731 . . . . 0.48999999999999999 111.757 -177.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.603 ' HZ2' ' HG3' ' A' ' 139' ' ' GLU . 19.0 m-90 -68.41 -42.53 78.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.694 0.283 . . . . 4.5199999999999996 110.614 -178.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.448 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 3.5 m-20 -57.75 -33.91 68.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 1.96 110.369 176.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.537 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 50.2 m -59.71 -40.77 89.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.116 -0.493 . . . . 1.24 111.488 178.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.55 ' CD2' ' HA ' ' A' ' 148' ' ' TRP . 19.5 m-85 -59.75 -36.16 76.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.248 0.547 . . . . 3.7200000000000002 109.756 -178.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.711 HG13 ' HA ' ' A' ' 46' ' ' VAL . 1.4 m -81.28 -24.54 10.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.652 -0.703 . . . . 1.8600000000000001 110.17 178.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' A' ' 150' ' ' THR . 11.2 mm-40 -59.19 -26.68 65.01 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.123 0.487 . . . . 1.6699999999999999 109.964 171.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 150' ' ' THR . 1.4 mt -97.53 -55.22 2.89 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.718 -0.673 . . . . 1.96 110.737 179.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 56.3 m-85 -112.47 16.98 19.65 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.059 -0.518 . . . . 4.3899999999999997 111.749 -170.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.611 ' HA2' ' HB1' ' A' ' 49' ' ' ALA . . . -63.8 159.77 38.74 Favored Glycine 0 CA--C 1.497 -1.071 0 CA-C-O 122.605 1.114 . . . . 1.1000000000000001 115.164 -168.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . 0.749 ' HB3' ' HB3' ' A' ' 48' ' ' GLN . 46.5 t-20 . . . . . 0 N--CA 1.426 -1.652 0 CA-C-N 112.599 -1.8 . . . . 1.29 109.68 -174.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.124 0 N-CA-C 113.829 0.292 . . . . 1.26 113.829 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -98.43 -13.59 20.51 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 113.027 0.751 . . . . 3.4500000000000002 113.027 177.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -97.13 -53.09 3.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.306 0.484 . . . . 1.54 112.306 -170.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.647 HD12 ' HE1' ' A' ' 65' ' ' PHE . 2.7 mm? -64.38 -46.93 81.24 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.832 -0.803 . . . . 1.8999999999999999 108.832 178.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 0.682 ' HA ' ' OE1' ' A' ' 89' ' ' GLU . . . -38.96 -51.8 1.79 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.326 -1.306 . . . . 1.45 111.739 167.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -77.67 -55.6 5.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.536 -1.211 . . . . 1.51 111.975 -173.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -66.02 -21.74 66.41 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.157 -0.474 . . . . 2.0699999999999998 110.692 -178.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1012 ' ' GLY . . . . . 0.475 ' HA2' ' CE1' ' A' ' 57' ' ' PHE . . . -80.27 -5.61 89.64 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.836 -0.62 . . . . 0.80000000000000004 112.796 -179.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.8 t70 -82.65 -8.78 59.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.323 0.583 . . . . 1.8999999999999999 109.892 174.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 3.2 m . . . . . 0 N--CA 1.45 -0.471 0 N-CA-C 108.488 -0.93 . . . . 1.4399999999999999 108.488 -179.986 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 . . . . . 0 C--O 1.223 -0.335 0 CA-C-O 120.884 0.373 . . . . 2.7599999999999998 110.153 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.7 p -60.27 -23.29 64.01 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.838 -0.619 . . . . 1.54 112.03 -179.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.555 ' HA ' HD23 ' A' ' 8' ' ' LEU . 3.9 p30 -67.58 -22.32 65.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.931 -0.577 . . . . 1.78 111.115 176.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.821 HH12 ' HA ' ' A' ' 128' ' ' ALA . 23.9 tpp180 -58.23 -50.69 72.67 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.235 0.541 . . . . 1.8999999999999999 109.864 175.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.488 ' OE1' ' HB2' ' A' ' 43' ' ' SER . 33.6 mt-10 -50.62 -55.71 15.13 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.324 -1.307 . . . . 0.68000000000000005 110.808 -179.084 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.627 HD12 HG13 ' A' ' 46' ' ' VAL . 2.8 mp -43.61 -45.97 7.01 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.151 -0.931 . . . . 1.8 111.345 176.694 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.5 t -70.2 -60.74 2.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.121 0.486 . . . . 1.0700000000000001 110.662 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.469 HG22 ' O ' ' A' ' 6' ' ' ARG . 63.7 t -53.57 -53.46 25.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.482 -0.781 . . . . 1.1299999999999999 112.477 -175.275 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -54.25 -35.37 62.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.483 -0.78 . . . . 0.58999999999999997 111.126 -175.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.566 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 15.2 t80 -88.34 -37.33 16.03 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 120.478 -0.489 . . . . 2.02 112.14 -175.538 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.989 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 2.8 mp -60.43 -36.93 79.34 Favored 'General case' 0 CA--C 1.521 -0.152 0 C-N-CA 119.386 -0.926 . . . . 1.0600000000000001 109.301 176.277 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.5 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 35.7 t -63.35 -37.37 87.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.642 -0.708 . . . . 1.6000000000000001 110.354 175.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -71.41 -26.09 62.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.666 -0.697 . . . . 1.49 110.48 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.69 ' HZ1' ' HH ' ' A' ' 61' ' ' TYR . 12.8 mmmt -75.86 -43.15 47.06 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 112.133 0.42 . . . . 1.8400000000000001 112.133 -179.227 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.57 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -59.53 -19.08 45.74 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.672 0.272 . . . . 1.98 111.327 177.139 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.1 t -60.37 -44.32 95.71 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.322 0.489 . . . . 1.3799999999999999 112.322 -176.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -66.97 -10.54 50.51 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.631 0.729 . . . . 1.51 111.673 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.549 ' HG3' HG13 ' A' ' 112' ' ' VAL . 19.8 mmmt -105.85 -30.2 9.53 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 122.079 0.942 . . . . 2.6499999999999999 108.936 -177.286 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.17 19.34 21.6 Favored Glycine 0 N--CA 1.442 -0.948 0 CA-C-N 114.297 -1.32 . . . . 0.54000000000000004 111.622 175.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -102.38 162.88 12.57 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.771 0.319 . . . . 1.1200000000000001 110.852 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.2 t -98.11 149.86 22.06 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 115.961 -0.563 . . . . 0.75 110.397 178.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.597 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 52.4 t-105 -77.84 -52.72 8.44 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.225 -0.898 . . . . 4.29 109.968 174.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.7 m -68.49 -22.16 64.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.823 -0.626 . . . . 1.8600000000000001 112.248 -172.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -67.2 -27.69 67.47 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.745 -0.382 . . . . 1.52 111.73 178.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -115.58 -8.48 12.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.215 -0.448 . . . . 1.53 111.894 -174.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.591 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 49.5 m -101.66 154.34 18.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.715 0.769 . . . . 2.04 113.066 -174.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.496 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.8 t70 -115.58 -14.8 11.48 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 113.879 -1.509 . . . . 2.3100000000000001 109.828 -179.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.648 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.0 m -48.48 -73.01 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.463 -1.244 . . . . 1.4099999999999999 113.092 -167.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.648 ' H ' HG23 ' A' ' 30' ' ' VAL . 44.2 mt-10 -92.14 0.89 57.47 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.561 -0.533 . . . . 2.7400000000000002 109.561 176.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.9 tt0 . . . . . 0 N--CA 1.45 -0.466 0 CA-C-N 115.547 -0.751 . . . . 1.45 110.482 -178.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.828 HG21 ' H ' ' A' ' 42' ' ' GLU . 2.2 t . . . . . 0 CA--C 1.538 0.509 0 CA-C-O 120.13 0.014 . . . . 1.45 111.022 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.828 ' H ' HG21 ' A' ' 41' ' ' THR . 13.9 pt-20 -92.91 -30.99 15.11 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 122.374 1.083 . . . . 2.02 109.454 174.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.795 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 66.3 m -69.84 -16.63 63.29 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 113.218 -1.81 . . . . 1.25 114.323 -167.159 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -42.81 -41.85 3.39 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 118.254 0.479 . . . . 1.9099999999999999 111.831 -178.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.4 ' HB3' HG21 ' A' ' 152' ' ' VAL . . . -83.65 -42.29 16.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.075 0.464 . . . . 1.1799999999999999 110.47 174.26 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.73 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 75.9 t -46.95 -66.91 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 C-N-CA 124.05 0.94 . . . . 2.0099999999999998 111.857 175.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.795 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.7 ptpt -61.27 -38.1 85.52 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.742 -0.663 . . . . 1.3799999999999999 110.462 -177.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.74 HE21 ' HA ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.61 -27.23 66.12 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 116.233 -0.44 . . . . 0.98999999999999999 110.958 175.365 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.743 ' HB1' ' HA2' ' A' ' 156' ' ' GLY . . . -83.84 -45.75 12.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.235 0.541 . . . . 1.1399999999999999 110.413 172.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.664 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -49.05 -42.25 37.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.826 -1.079 . . . . 1.95 112.003 -179.697 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.638 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.4 ptp180 -76.88 -28.45 55.4 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.336 0.589 . . . . 2.5099999999999998 110.017 -170.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.43 ' HG2' ' HG3' ' A' ' 51' ' ' ARG . 19.1 mm-40 -77.85 -44.18 28.05 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.911 -1.041 . . . . 1.1000000000000001 110.182 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.21 -43.46 98.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.665 -0.698 . . . . 1.04 109.695 174.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.681 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.87 -41.46 99.87 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-N 115.556 -0.747 . . . . 0.69999999999999996 111.48 175.054 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -52.56 -39.3 61.32 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 122.786 0.434 . . . . 1.04 111.123 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -80.05 -27.19 39.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.12 -0.491 . . . . 2.29 111.498 178.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.891 ' HZ ' ' HA2' ' B' 1012 ' ' GLY . 1.4 t80 -80.84 -27.46 36.46 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.537 -0.301 . . . . 2.9300000000000002 111.235 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.784 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 47.7 mt-10 -56.26 -65.48 0.6 Allowed 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 111.932 0.345 . . . . 1.3 111.932 -176.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.746 HD22 ' N ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -52.05 -35.44 47.31 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.323 0.39 . . . . 2.1899999999999999 111.337 -178.616 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.746 ' N ' HD22 ' A' ' 59' ' ' LEU . 46.0 mtt180 -52.83 -55.18 24.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.58 -0.736 . . . . 3.1400000000000001 111.756 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.784 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 29.3 p90 -90.78 -19.68 23.21 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.682 -0.407 . . . . 5.5899999999999999 111.757 -177.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -58.81 -30.11 67.39 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 122.681 0.392 . . . . 4.9299999999999997 111.55 -174.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -62.64 -37.16 85.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 5.3499999999999996 110.685 178.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.403 ' HB2' HD13 ' A' ' 68' ' ' LEU . . . -90.41 -31.23 16.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.426 . . . . 1.7 110.807 178.115 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.573 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 56.9 t80 -42.55 -48.47 5.34 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.821 0.848 . . . . 3.52 113.199 -174.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.5 t -62.75 -38.14 89.37 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.861 0.362 . . . . 2.5899999999999999 110.945 -174.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -87.57 -28.14 22.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.0 0.429 . . . . 2.7200000000000002 110.762 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.628 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 0.5 OUTLIER -60.13 -22.5 62.91 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 113.099 0.777 . . . . 2.25 113.099 -175.349 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.466 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 4.8 p -52.99 -26.99 17.09 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 117.999 0.363 . . . . 1.26 111.391 -179.549 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.7 t -58.98 -58.25 9.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.377 0.608 . . . . 1.8 110.055 173.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.835 ' H ' ' NE2' ' A' ' 71' ' ' GLN . 1.9 mp0 -51.35 -45.59 62.41 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 124.397 1.079 . . . . 1.8899999999999999 111.161 174.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.479 ' HB3' ' CD1' ' A' ' 74' ' ' ILE . 2.4 mm? -66.62 -31.86 72.82 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 116.056 -0.52 . . . . 1.98 111.834 179.082 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.9 m80 57.1 42.64 25.49 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.65 -0.87 . . . . 3.54 108.65 -174.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.503 HG23 ' HB3' ' A' ' 113' ' ' GLU . 31.9 mm -49.67 115.66 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 113.582 -1.644 . . . . 1.1499999999999999 113.141 -173.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.769 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -157.04 -171.61 0.29 Allowed Pre-proline 0 CA--C 1.551 0.988 0 CA-C-N 114.272 -1.331 . . . . 1.1200000000000001 107.798 -171.796 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.769 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 41.0 Cg_exo -28.63 166.67 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.335 1 C-N-CA 125.453 4.102 . . . . 0.53000000000000003 115.976 164.895 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.404 ' HA2' ' CD1' ' A' ' 122' ' ' LEU . . . -31.5 -27.17 0.01 OUTLIER Glycine 0 N--CA 1.474 1.203 0 N-CA-C 117.441 1.737 . . . . 0.40999999999999998 117.441 -173.078 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.432 ' N ' ' O ' ' A' ' 76' ' ' PRO . 24.1 p -69.39 4.34 1.81 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 117.888 0.844 . . . . 1.22 112.007 -179.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.19 -14.58 63.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 121.393 0.616 . . . . 1.0700000000000001 109.742 172.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -76.6 -14.73 59.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.687 -0.688 . . . . 4.3099999999999996 109.92 176.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.48 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 37.3 mt-30 -86.99 -24.11 24.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.623 0.725 . . . . 1.03 109.978 173.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.0 m -71.22 -51.19 26.08 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.711 -1.131 . . . . 0.47999999999999998 109.249 170.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -68.2 -15.94 63.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.82 -1.082 . . . . 1.4399999999999999 110.202 174.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.623 ' HA ' HG11 ' A' ' 87' ' ' VAL . 41.5 tt0 -64.22 -50.55 67.6 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.172 0.51 . . . . 0.80000000000000004 110.257 176.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -44.43 -43.63 7.87 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 114.414 -1.266 . . . . 1.99 111.302 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.66 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.6 p -91.45 -36.77 8.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 CA-C-N 113.546 -1.661 . . . . 1.8999999999999999 112.039 -171.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.623 HG11 ' HA ' ' A' ' 84' ' ' GLU . 6.9 p -66.38 -21.31 28.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 121.845 0.831 . . . . 1.4299999999999999 109.277 175.333 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.607 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.5 m-80 -72.74 -51.47 19.04 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.193 -1.367 . . . . 0.91000000000000003 111.137 175.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 1.041 ' HG2' ' HA2' ' B' 1005 ' ' GLY . 0.0 OUTLIER -64.96 -40.04 94.39 Favored 'General case' 0 CA--C 1.496 -1.109 0 N-CA-C 108.77 -0.826 . . . . 2.8700000000000001 108.77 -178.622 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.596 ' HG ' ' OE1' ' A' ' 89' ' ' GLU . 15.5 mt -57.21 -27.08 61.68 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-N 113.851 -1.522 . . . . 1.9199999999999999 110.8 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.602 ' HA ' HG23 ' A' ' 95' ' ' VAL . 76.4 t80 -97.4 -49.05 5.06 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.341 0.591 . . . . 2.9700000000000002 110.727 -171.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.607 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER -75.56 -32.77 60.52 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.595 -0.73 . . . . 5.6699999999999999 110.885 -173.095 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.509 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 1.4 m-20 -94.55 20.17 8.81 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.676 -0.693 . . . . 3.1200000000000001 112.549 -174.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.69 70.97 0.11 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 117.182 -2.437 . . . . 2.3100000000000001 116.116 177.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 1.051 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 46.6 t -75.88 98.86 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 118.927 1.363 . . . . 1.6799999999999999 111.271 171.714 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -113.35 -170.94 1.78 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.953 -1.021 . . . . 2.1200000000000001 109.601 177.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.674 ' HA ' ' CE2' ' A' ' 151' ' ' PHE . 13.6 m-90 -61.79 -46.7 88.42 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.112 -0.495 . . . . 4.1200000000000001 110.643 178.297 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -78.54 -20.37 71.73 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.89 -0.595 . . . . 0.80000000000000004 113.9 -174.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 1.051 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -68.91 -30.57 69.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 117.336 0.568 . . . . 4.9100000000000001 110.0 -176.335 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 85.4 mt -76.76 -32.36 20.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.329 -0.396 . . . . 1.1100000000000001 110.642 -178.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.444 ' HA ' ' CD1' ' A' ' 104' ' ' PHE . 0.8 OUTLIER -63.84 -26.48 40.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-O 121.321 0.581 . . . . 2.0299999999999998 109.51 172.038 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -73.77 -49.24 26.37 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.396 -0.594 . . . . 1.0600000000000001 109.396 173.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.66 ' HB2' ' NH1' ' A' ' 99' ' ' ARG . 32.7 t80 -49.93 -55.42 14.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.731 -1.122 . . . . 1.8400000000000001 111.697 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.866 ' HA ' ' HE1' ' A' ' 130' ' ' MET . 0.2 OUTLIER -72.54 -18.46 61.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.974 0.416 . . . . 4.21 110.733 -174.278 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.549 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 23.0 t -81.75 -44.32 17.18 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.219 -0.446 . . . . 1.55 110.524 177.475 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . 0.555 ' CZ ' HD11 ' B' 1008 ' ' LEU . 19.9 m-30 -65.41 -39.92 92.74 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 116.441 -0.345 . . . . 3.6400000000000001 110.107 178.556 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . 0.827 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -64.49 -37.25 94.19 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.821 -0.704 . . . . 0.32000000000000001 111.673 176.695 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.989 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.9 -34.56 87.5 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 120.539 -0.839 . . . . 0.23999999999999999 111.407 175.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.573 ' HB2' ' CE1' ' A' ' 65' ' ' PHE . . . -72.23 -34.1 68.06 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.8 0.333 . . . . 1.05 110.463 176.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.555 ' HB3' HD12 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -60.65 -40.14 90.93 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 122.21 1.005 . . . . 1.78 108.514 179.564 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.656 ' SG ' HG23 ' A' ' 123' ' ' VAL . 33.3 t -52.74 -53.92 41.11 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 113.74 -1.573 . . . . 0.90000000000000002 110.344 173.322 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.549 HG13 ' HG3' ' A' ' 20' ' ' LYS . 54.4 t -61.21 -42.32 92.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.031 -0.531 . . . . 1.2 111.54 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.503 ' HB3' HG23 ' A' ' 74' ' ' ILE . 32.1 mt-10 -55.41 -34.11 64.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.053 0.454 . . . . 2.5099999999999998 110.797 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.434 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 30.3 m -74.14 -38.09 63.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.466 0.65 . . . . 0.28000000000000003 109.268 178.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.619 ' HA ' ' HG3' ' A' ' 120' ' ' GLN . 85.9 t -67.51 -34.29 67.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 115.127 -0.942 . . . . 1.8300000000000001 109.538 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.48 -50.31 60.1 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.594 -1.639 . . . . 0.59999999999999998 111.381 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.422 ' CG ' ' HE3' ' A' ' 119' ' ' MET . 10.6 mmtp -89.74 11.9 18.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.03 -0.532 . . . . 2.1600000000000001 110.541 -179.012 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 61.8 56.29 2.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.93 0.871 . . . . 1.8799999999999999 110.588 -176.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.422 ' HE3' ' CG ' ' A' ' 117' ' ' LYS . 32.7 mtm -129.44 43.68 3.1 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.388 -1.278 . . . . 1.0800000000000001 107.61 178.034 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.619 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 14.1 mp0 -61.35 -7.14 2.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.877 -1.056 . . . . 1.1499999999999999 113.199 -172.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.616 HG23 HD21 ' A' ' 122' ' ' LEU . 17.9 m -62.94 -28.53 45.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 O-C-N 121.916 -0.49 . . . . 1.1899999999999999 111.187 173.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.755 HD12 ' HD2' ' A' ' 125' ' ' ARG . 3.4 mm? -69.36 -28.08 65.89 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 110.267 -0.271 . . . . 1.0600000000000001 110.267 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.656 HG23 ' SG ' ' A' ' 111' ' ' CYS . 54.7 t -43.04 -53.91 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 O-C-N 123.955 0.784 . . . . 1.0 112.124 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.591 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 3.3 t -75.1 -34.89 61.78 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.877 0.37 . . . . 1.6599999999999999 110.662 -178.484 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.755 ' HD2' HD12 ' A' ' 122' ' ' LEU . 93.0 mtt180 -64.22 -50.28 68.63 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.081 -0.509 . . . . 3.2999999999999998 110.803 -177.043 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.555 HD12 ' HB3' ' A' ' 110' ' ' LEU . 75.8 mt -55.12 -50.03 67.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.675 -0.693 . . . . 1.0600000000000001 110.614 179.361 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.597 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -56.7 -34.2 67.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.408 -0.36 . . . . 1.1000000000000001 111.639 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.821 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -59.41 -61.93 2.26 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.36 0.6 . . . . 1.1200000000000001 110.448 175.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -62.17 -31.87 72.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.853 -1.067 . . . . 4.7699999999999996 111.258 -177.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.866 ' HE1' ' HA ' ' A' ' 104' ' ' PHE . 7.5 mmm -61.91 -59.83 4.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.212 -0.449 . . . . 1.0900000000000001 111.683 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -64.01 -36.32 83.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.429 -0.35 . . . . 1.05 110.78 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' THR . . . . . 0.436 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 52.1 m -66.9 -39.21 87.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.416 -0.356 . . . . 1.1299999999999999 111.127 177.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . 0.539 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 55.4 t80 -60.31 -43.16 96.6 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.801 -0.444 . . . . 3.3500000000000001 109.801 175.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.495 HD11 ' HB2' ' A' ' 5' ' ' ASN . 5.7 tt -60.34 -50.27 74.29 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.745 -0.835 . . . . 1.5900000000000001 108.745 174.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . 0.436 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 3.8 m-80 -48.98 -58.31 5.1 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.932 -0.576 . . . . 0.46000000000000002 112.443 178.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -80.23 -45.03 18.7 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 0.58999999999999997 112.054 -172.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . 0.539 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 8.2 m80 -91.97 -50.55 5.65 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.361 0.874 . . . . 2.3399999999999999 113.361 -171.155 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.54 HD23 ' NH2' ' A' ' 99' ' ' ARG . 58.8 mt -91.75 -34.96 14.41 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.607 0.966 . . . . 1.8999999999999999 113.607 -165.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.627 ' HA ' HD12 ' A' ' 142' ' ' ILE . 31.7 tt0 -51.38 -49.84 79.75 Favored Pre-proline 0 C--N 1.324 -0.526 0 O-C-N 123.313 0.383 . . . . 0.75 111.657 -174.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.54 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 52.8 Cg_exo -52.87 -51.31 11.39 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 121.772 1.648 . . . . 0.87 111.624 175.316 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -54.5 -54.22 43.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.45 -0.795 . . . . 1.4299999999999999 110.544 178.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.627 HD12 ' HA ' ' A' ' 139' ' ' GLU . 13.6 mt -42.84 -51.84 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.406 -0.815 . . . . 1.1299999999999999 111.961 175.262 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.609 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 14.8 mm-40 -67.07 -30.01 69.94 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.934 -0.576 . . . . 0.57999999999999996 111.747 -176.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.54 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.0 mm-40 -68.28 -22.28 64.75 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.498 0.666 . . . . 0.78000000000000003 110.7 175.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.636 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -101.72 3.84 40.03 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.28 -0.873 . . . . 0.93000000000000005 108.974 -174.767 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 125.48 -34.02 3.45 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.696 -1.138 . . . . 0.56000000000000005 113.135 173.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 111.7 162.92 17.18 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 111.1 -0.8 . . . . 0.48999999999999999 111.1 -174.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.566 ' HB3' ' CG2' ' A' ' 46' ' ' VAL . 39.9 m95 -58.21 -33.59 69.48 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.124 0.787 . . . . 4.5199999999999996 113.124 -172.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.503 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 29.8 m-20 -56.56 -42.87 79.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.852 0.358 . . . . 1.96 110.082 176.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' THR . . . . . 0.523 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 25.1 m -60.59 -36.48 78.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.733 -0.667 . . . . 1.24 111.721 179.064 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . 0.674 ' CE2' ' HA ' ' A' ' 97' ' ' TRP . 2.2 m-85 -62.81 -39.68 95.04 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.184 0.516 . . . . 3.7200000000000002 109.641 -177.714 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.61 ' HB ' ' HB1' ' A' ' 49' ' ' ALA . 1.4 m -75.5 -24.44 17.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.859 -0.61 . . . . 1.8600000000000001 110.053 176.114 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 12.8 mm-40 -60.88 -23.46 65.2 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 121.672 -0.642 . . . . 1.6699999999999999 110.478 173.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.6 mt -96.23 -56.04 2.76 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.886 -0.597 . . . . 1.96 110.101 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . 0.662 ' OH ' ' HB3' ' A' ' 151' ' ' PHE . 12.0 p90 -121.55 26.51 8.75 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.289 0.566 . . . . 4.3899999999999997 112.49 -173.161 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.743 ' HA2' ' HB1' ' A' ' 49' ' ' ALA . . . -61.48 161.4 26.68 Favored Glycine 0 C--N 1.305 -1.185 0 CA-C-N 115.165 -0.925 . . . . 1.1000000000000001 113.442 -178.003 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . 0.547 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 26.0 t-20 . . . . . 0 C--N 1.31 -1.117 0 CA-C-N 114.011 -1.094 . . . . 1.29 111.299 179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1005 ' ' GLY . . . . . 1.041 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.535 1.302 0 N-CA-C 114.984 0.754 . . . . 1.26 114.984 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 8.2 mpt_? -85.77 -33.83 21.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 117.635 0.717 . . . . 3.4500000000000002 111.636 175.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -95.15 -55.58 3.02 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.527 0.566 . . . . 1.54 112.527 -167.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.662 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 2.9 mm? -65.89 -44.26 85.8 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.705 -0.48 . . . . 1.8999999999999999 109.705 -175.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 0.945 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -42.93 -44.5 4.61 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 122.474 1.13 . . . . 1.45 110.502 172.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -79.92 -51.16 9.45 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 113.467 -1.697 . . . . 1.51 111.204 -175.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -66.61 -19.84 65.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.152 -0.476 . . . . 2.0699999999999998 110.913 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1012 ' ' GLY . . . . . 0.891 ' HA2' ' HZ ' ' A' ' 57' ' ' PHE . . . -82.23 -2.6 90.62 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 116.006 -0.543 . . . . 0.80000000000000004 113.033 -178.046 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 39.0 t70 -88.6 7.1 35.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.539 0.685 . . . . 1.8999999999999999 109.933 170.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 2.7 m . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 115.949 -0.568 . . . . 1.4399999999999999 110.158 178.182 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 . . . . . 0 N--CA 1.457 -0.077 0 CA-C-O 120.693 0.282 . . . . 2.7599999999999998 111.091 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.2 p -63.96 -37.19 86.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.477 -0.329 . . . . 1.54 111.137 -179.791 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.59 ' HA ' HD11 ' A' ' 8' ' ' LEU . 23.9 p30 -64.65 -17.11 63.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.684 0.278 . . . . 1.78 110.869 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.52 ' NH1' ' HA ' ' A' ' 128' ' ' ALA . 9.9 tpp180 -60.22 -39.7 87.56 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.056 0.455 . . . . 1.8999999999999999 109.85 178.999 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -64.41 -42.54 96.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.625 -0.716 . . . . 0.68000000000000005 110.423 179.579 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.59 HD11 ' HA ' ' A' ' 5' ' ' ASN . 8.9 mp -54.36 -39.56 67.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.812 -0.631 . . . . 1.8 110.401 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.449 HG11 ' HB2' ' A' ' 130' ' ' MET . 91.6 t -73.37 -64.8 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.927 -0.579 . . . . 1.0700000000000001 110.086 178.98 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 52.4 t -44.8 -66.77 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.254 -0.884 . . . . 1.1299999999999999 112.178 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -43.32 -33.58 1.03 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.58999999999999997 112.137 -179.226 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.432 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.2 t80 -77.33 -46.68 22.15 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.107 -0.237 . . . . 2.02 111.221 -179.556 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.63 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 10.0 mp -60.45 -37.51 81.2 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.948 0.404 . . . . 1.0600000000000001 110.525 179.536 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.432 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 38.3 t -68.13 -42.51 80.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.873 -0.603 . . . . 1.6000000000000001 110.195 179.635 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -68.9 -24.28 64.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.713 -0.676 . . . . 1.49 110.442 179.596 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.492 ' HG3' HG23 ' A' ' 112' ' ' VAL . 1.9 tppt? -85.34 -16.52 39.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.942 -0.572 . . . . 1.8400000000000001 110.775 -179.761 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 mp -90.04 -13.92 34.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.072 -0.513 . . . . 1.98 110.116 179.263 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 72.6 m -75.27 -35.88 61.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.788 -0.642 . . . . 1.3799999999999999 110.728 179.702 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -70.55 -4.84 25.04 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.318 -0.401 . . . . 1.51 110.473 179.769 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.414 ' HG3' HG13 ' A' ' 112' ' ' VAL . 29.7 mmmt -109.51 -26.04 10.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.849 -0.614 . . . . 2.6499999999999999 110.775 -179.845 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.03 4.29 44.88 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.841 -0.695 . . . . 0.54000000000000004 111.98 -179.402 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -102.1 160.9 14.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.854 0.359 . . . . 1.1200000000000001 110.855 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.1 t -110.79 138.73 46.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.063 -0.517 . . . . 0.75 110.573 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.432 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 11.6 t90 -68.01 -45.36 74.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.066 -0.516 . . . . 4.29 111.085 -179.934 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.445 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 50.9 m -56.96 -41.68 78.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 1.8600000000000001 111.834 -179.369 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -56.59 -24.02 44.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.298 -0.41 . . . . 1.52 112.044 -179.227 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -126.7 16.0 7.52 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.878 0.325 . . . . 1.53 111.878 -179.08 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.532 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 83.6 p -99.9 -179.99 4.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.12 0.486 . . . . 2.04 111.413 -179.792 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.456 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 9.7 t70 -166.07 -15.34 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.394 -0.821 . . . . 2.3100000000000001 109.868 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.688 HG21 ' H ' ' A' ' 31' ' ' GLU . 0.6 OUTLIER -58.58 -75.99 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.319 -0.855 . . . . 1.4099999999999999 111.809 -179.833 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.688 ' H ' HG21 ' A' ' 30' ' ' VAL . 42.8 mt-10 -87.5 -3.43 59.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.927 0.394 . . . . 2.7400000000000002 110.682 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.456 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 38.7 tt0 . . . . . 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 1.45 111.367 -179.627 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.529 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.95 0.405 . . . . 1.45 110.491 . . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.529 ' H ' HG23 ' A' ' 41' ' ' THR . 12.2 pt-20 -124.07 -19.6 5.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.423 0.63 . . . . 2.02 109.377 179.084 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.539 ' HA ' HG22 ' A' ' 46' ' ' VAL . 27.1 m -72.77 -23.34 60.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.918 -1.037 . . . . 1.25 112.409 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -52.28 -36.36 52.59 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.094 0.405 . . . . 1.9099999999999999 112.094 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -91.81 -36.17 13.68 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.172 0.434 . . . . 1.1799999999999999 112.172 -179.024 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.539 HG22 ' HA ' ' A' ' 43' ' ' SER . 1.5 m -75.27 -28.12 20.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 111.876 0.324 . . . . 2.0099999999999998 111.876 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.6 ptmt -77.94 -34.21 51.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.887 0.375 . . . . 1.3799999999999999 110.121 -179.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.468 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 11.0 mm100 -68.61 -36.32 78.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.861 -0.609 . . . . 0.98999999999999999 109.423 178.745 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.418 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -77.59 -31.7 53.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.532 -0.758 . . . . 1.1399999999999999 109.47 178.544 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 46' ' ' VAL . 28.9 tp -67.41 -31.65 72.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.972 -1.013 . . . . 1.95 110.082 179.39 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -70.06 -40.45 75.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.263 -0.881 . . . . 2.5099999999999998 110.543 179.6 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.9 -45.97 69.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.927 -0.579 . . . . 1.1000000000000001 110.707 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.99 -36.54 83.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 1.04 110.925 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.44 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -72.0 -37.88 60.14 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.811 -0.709 . . . . 0.69999999999999996 112.395 -179.985 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -55.35 -43.81 75.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.69 0.281 . . . . 1.04 111.386 -179.798 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -72.65 -16.68 61.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.335 -0.393 . . . . 2.29 111.49 -179.602 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -90.33 -31.46 16.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.578 -0.283 . . . . 2.9300000000000002 111.26 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 49.2 mt-10 -63.84 -60.79 2.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.428 -0.351 . . . . 1.3 111.549 -179.523 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.449 HD12 ' N ' ' A' ' 60' ' ' ARG . 3.8 pp -54.97 -20.42 9.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.055 -0.521 . . . . 2.1899999999999999 111.758 -179.347 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.449 ' N ' HD12 ' A' ' 59' ' ' LEU . 23.4 ttm180 -66.66 -38.5 86.97 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.2 0.445 . . . . 3.1400000000000001 112.2 -178.818 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -129.63 15.15 5.97 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.133 -0.227 . . . . 5.5899999999999999 111.449 -179.389 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -50.49 -47.0 57.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.501 -0.318 . . . . 4.9299999999999997 111.642 -179.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -32.33 54.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.171 -0.468 . . . . 5.3499999999999996 111.61 -179.2 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.22 -26.51 18.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.909 0.385 . . . . 1.7 111.083 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.405 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -58.31 -39.25 78.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.944 -0.571 . . . . 3.52 111.635 -179.33 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 69.6 m -76.5 -25.7 54.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.798 0.332 . . . . 2.5899999999999999 111.16 -179.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -93.7 -12.33 29.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.155 -0.475 . . . . 2.7200000000000002 111.045 -179.463 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.2 mp -80.91 -9.04 59.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 2.25 111.143 -179.491 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 46.0 p -59.8 -31.03 69.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 1.26 110.874 179.765 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -77.01 -36.88 55.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.962 -0.563 . . . . 1.8 110.74 179.842 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -74.53 -23.62 58.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 1.8899999999999999 110.534 179.78 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 44.7 mt -92.87 -18.22 23.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.811 -0.632 . . . . 1.98 110.989 -179.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 m80 55.69 49.46 16.3 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 110.117 -0.327 . . . . 3.54 110.117 -179.081 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.524 HG13 ' HB3' ' A' ' 113' ' ' GLU . 37.8 mm -49.56 93.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.991 -0.549 . . . . 1.1499999999999999 110.968 -179.755 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.495 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.4 OUTLIER -130.94 164.6 40.96 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 115.478 -0.783 . . . . 1.1200000000000001 110.028 -179.368 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.53 ' HA ' HD23 ' A' ' 122' ' ' LEU . 12.4 Cg_endo -55.62 142.07 82.58 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.191 1.928 . . . . 0.53000000000000003 113.61 -179.234 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.61 ' H ' HD13 ' A' ' 122' ' ' LEU . . . 63.92 -77.56 0.05 OUTLIER Glycine 0 CA--C 1.52 0.401 0 CA-C-N 115.464 -0.789 . . . . 0.40999999999999998 114.828 178.17 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.415 HG23 ' NE2' ' A' ' 81' ' ' GLN . 58.9 p -55.05 -4.83 0.08 Allowed 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 113.652 0.982 . . . . 1.22 113.652 -177.931 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 75' ' ' THR . . . -60.11 -24.8 64.95 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 121.483 0.659 . . . . 1.0700000000000001 109.233 178.447 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -69.1 -32.83 72.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.83 -1.077 . . . . 4.3099999999999996 110.091 179.242 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.415 ' NE2' HG23 ' A' ' 78' ' ' THR . 46.9 mt-30 -72.48 -25.47 61.44 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.269 0.557 . . . . 1.03 109.623 178.532 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.3 m -75.73 -40.44 55.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.442 -0.799 . . . . 0.47999999999999998 108.9 178.548 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -74.89 -14.59 60.68 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.921 -1.036 . . . . 1.4399999999999999 109.044 178.505 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.508 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.4 tt0 -67.77 -42.3 81.92 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.28 -0.873 . . . . 0.80000000000000004 110.39 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -60.36 -25.62 65.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.034 -0.53 . . . . 1.99 110.618 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.403 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 41.4 t -87.31 -50.09 14.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.833 -0.621 . . . . 1.8999999999999999 111.401 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.508 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.2 p -63.69 -26.85 41.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.444 -0.344 . . . . 1.4299999999999999 111.107 -179.719 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -67.14 -39.14 86.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.987 0.422 . . . . 0.91000000000000003 110.535 179.632 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.666 ' HA ' ' HD2' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -89.93 -4.18 57.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.884 -0.598 . . . . 2.8700000000000001 110.532 179.571 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.612 HD12 HH11 ' A' ' 99' ' ' ARG . 3.7 tp -93.59 9.21 37.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.736 -0.666 . . . . 1.9199999999999999 111.291 -179.295 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.553 ' HA ' HG21 ' A' ' 95' ' ' VAL . 2.8 p90 -144.44 -28.66 0.49 Allowed 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.692 -0.403 . . . . 2.9700000000000002 111.937 -179.992 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.666 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -77.8 -22.88 49.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.73 0.3 . . . . 5.6699999999999999 110.971 -179.514 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.419 ' N ' ' HD3' ' A' ' 92' ' ' ARG . 19.9 t70 -88.92 2.49 53.72 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 3.1200000000000001 110.62 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 113.66 109.91 2.91 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.855 -0.688 . . . . 2.3100000000000001 112.389 -179.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.553 HG21 ' HA ' ' A' ' 91' ' ' PHE . 42.2 t -79.16 90.22 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.862 0.363 . . . . 1.6799999999999999 111.01 179.99 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' ASN . . . . . 0.631 HD21 ' N ' ' A' ' 96' ' ' ASN . 0.7 OUTLIER -89.48 178.34 6.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.048 -0.524 . . . . 2.1200000000000001 110.348 179.653 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 22.1 m-90 -60.55 -60.57 3.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.032 0.444 . . . . 4.1200000000000001 110.146 179.121 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.468 ' O ' HG22 ' A' ' 101' ' ' VAL . . . -64.45 -26.19 70.58 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.618 -0.719 . . . . 0.80000000000000004 111.996 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.612 HH11 HD12 ' A' ' 90' ' ' LEU . 13.5 tpp180 -56.06 -36.04 67.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.21 0.528 . . . . 4.9100000000000001 110.162 179.376 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.593 HG23 HD23 ' A' ' 138' ' ' LEU . 37.9 mt -71.99 -37.67 61.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.445 -0.798 . . . . 1.1100000000000001 111.198 -179.775 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.468 HG22 ' O ' ' A' ' 98' ' ' GLY . 1.0 OUTLIER -63.23 -29.8 48.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.03 0.443 . . . . 2.0299999999999998 109.958 179.616 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.19 -28.98 67.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.705 -0.68 . . . . 1.0600000000000001 109.509 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.476 ' HB2' HD23 ' A' ' 90' ' ' LEU . 86.3 t80 -72.06 -22.27 61.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.97 -1.014 . . . . 1.8400000000000001 110.207 179.455 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.437 ' HE2' HG21 ' A' ' 100' ' ' ILE . 72.2 m-85 -90.86 -46.02 8.45 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.773 -0.649 . . . . 4.21 111.201 179.765 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.432 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 19.7 p -62.01 -40.65 96.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.937 -0.574 . . . . 1.55 110.665 -179.954 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -80.25 -41.91 24.19 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.18 -0.463 . . . . 3.6400000000000001 110.591 179.864 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.91 -43.76 98.95 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.451 -0.88 . . . . 0.32000000000000001 111.12 178.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 108' ' ' GLY . . . . . 0.63 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -70.67 -28.65 70.57 Favored Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 110.591 -1.004 . . . . 0.23999999999999999 110.591 178.449 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.405 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -70.55 -30.84 67.67 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.256 -0.646 . . . . 1.05 109.256 178.338 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.458 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -65.3 -33.74 76.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.446 -0.797 . . . . 1.78 108.896 178.851 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.463 ' SG ' HG23 ' A' ' 123' ' ' VAL . 3.2 t -68.12 -38.49 82.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.184 -0.916 . . . . 0.90000000000000002 109.955 178.906 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 112' ' ' VAL . . . . . 0.492 HG23 ' HG3' ' A' ' 16' ' ' LYS . 74.7 t -70.1 -39.23 76.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.725 -0.67 . . . . 1.2 110.534 179.339 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.524 ' HB3' HG13 ' A' ' 74' ' ' ILE . 31.0 mt-10 -67.65 -21.15 65.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.038 -0.528 . . . . 2.5099999999999998 109.948 179.454 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 114' ' ' SER . . . . . 0.451 ' HB3' ' HB2' ' A' ' 122' ' ' LEU . 74.9 m -77.23 -50.16 13.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.677 -0.692 . . . . 0.28000000000000003 109.867 179.07 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.401 HG11 ' HA ' ' A' ' 112' ' ' VAL . 3.4 p -66.65 -21.82 29.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.059 -0.519 . . . . 1.8300000000000001 109.983 179.001 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -63.63 -37.85 88.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.64 -0.709 . . . . 0.59999999999999998 110.492 179.477 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -93.69 22.29 5.64 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.992 -0.549 . . . . 2.1600000000000001 110.716 179.898 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 67.77 22.32 8.9 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.205 -0.452 . . . . 1.8799999999999999 110.936 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 119' ' ' MET . . . . . 0.483 ' SD ' ' HD3' ' A' ' 76' ' ' PRO . 10.4 mtm -114.77 78.01 1.12 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.251 -0.431 . . . . 1.0800000000000001 110.506 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -84.59 -3.5 58.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.474 -0.33 . . . . 1.1499999999999999 111.668 -179.219 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.571 HG23 HD22 ' A' ' 122' ' ' LEU . 25.4 m -72.61 -5.91 7.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.855 0.36 . . . . 1.1899999999999999 110.914 179.87 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.61 HD13 ' H ' ' A' ' 77' ' ' GLY . 4.1 mm? -93.09 -16.87 24.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.043 -0.526 . . . . 1.0600000000000001 110.063 179.123 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.463 HG23 ' SG ' ' A' ' 111' ' ' CYS . 94.3 t -52.72 -59.08 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.786 -0.643 . . . . 1.0 111.074 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 124' ' ' SER . . . . . 0.532 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 37.5 t -65.83 -36.76 84.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.032 -0.531 . . . . 1.6599999999999999 111.449 -179.692 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . 0.602 ' HD2' HD11 ' A' ' 122' ' ' LEU . 94.4 mtt180 -60.74 -67.12 0.43 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.507 -0.315 . . . . 3.2999999999999998 111.248 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 126' ' ' ILE . . . . . 0.458 HD13 ' HB3' ' A' ' 110' ' ' LEU . 74.6 mt -44.82 -42.68 2.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.044 -0.525 . . . . 1.0600000000000001 111.489 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.498 ' HB1' HD22 ' A' ' 13' ' ' LEU . . . -56.62 -42.52 78.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.416 -0.357 . . . . 1.1000000000000001 111.057 179.855 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.52 ' HA ' ' NH1' ' A' ' 6' ' ' ARG . . . -69.13 -41.47 77.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.031 -0.531 . . . . 1.1200000000000001 111.376 -179.963 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -64.31 -39.36 93.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.325 -0.398 . . . . 4.7699999999999996 111.32 -179.778 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.449 ' HB2' HG11 ' A' ' 9' ' ' VAL . 89.2 mtp -65.16 -52.83 52.65 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.19 -0.459 . . . . 1.0900000000000001 111.083 -179.574 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -57.8 -53.91 52.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.277 -0.419 . . . . 1.05 110.749 179.788 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.8 m -54.22 -49.73 68.76 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.052 -0.522 . . . . 1.1299999999999999 111.066 179.869 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -57.03 -30.78 64.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.151 0.5 . . . . 3.3500000000000001 110.052 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . 0.411 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 3.6 tt -81.28 -23.2 38.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.55 -0.75 . . . . 1.5900000000000001 110.119 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -83.06 -6.91 59.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 0.46000000000000002 112.06 -179.525 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -126.99 -30.47 2.71 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.126 0.787 . . . . 0.58999999999999997 113.126 -178.148 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 8.3 m80 -107.54 -52.36 2.77 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.29 0.848 . . . . 2.3399999999999999 113.29 -178.124 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.593 HD23 HG23 ' A' ' 100' ' ' ILE . 10.1 mp -80.84 -37.24 30.33 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.858 1.059 . . . . 1.8999999999999999 113.858 -177.102 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.436 ' N ' ' HD2' ' A' ' 140' ' ' PRO . 34.8 tt0 -48.73 -53.84 32.88 Favored Pre-proline 0 N--CA 1.468 0.453 0 N-CA-C 112.407 0.521 . . . . 0.75 112.407 -178.073 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . 0.442 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 37.2 Cg_endo -65.6 -28.58 52.81 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.733 1.622 . . . . 0.87 112.272 -179.623 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 141' ' ' TRP . . . . . 0.431 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 1.2 t-105 -78.57 -30.01 46.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 1.4299999999999999 111.155 -179.612 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 142' ' ' ILE . . . . . 0.667 HG21 ' HA2' ' A' ' 147' ' ' GLY . 60.5 mt -69.83 -40.22 78.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.969 -0.559 . . . . 1.1299999999999999 110.656 -179.706 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 79.0 mm-40 -63.08 -28.68 70.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.519 . . . . 0.57999999999999996 110.114 179.322 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 16.5 mm-40 -69.62 -23.8 63.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.847 -0.615 . . . . 0.78000000000000003 110.235 179.301 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 145' ' ' ASN . . . . . 0.561 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.8 OUTLIER -97.51 -1.37 44.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.712 -0.676 . . . . 0.93000000000000005 110.718 -179.994 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.14 -35.91 3.61 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.869 -0.682 . . . . 0.56000000000000005 112.812 179.758 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . 0.667 ' HA2' HG21 ' A' ' 142' ' ' ILE . . . 117.15 167.31 14.39 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.806 -0.711 . . . . 0.48999999999999999 112.155 -179.741 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 148' ' ' TRP . . . . . 0.552 ' NE1' HD12 ' A' ' 142' ' ' ILE . 10.7 m-90 -57.76 -38.24 75.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.061 0.458 . . . . 4.5199999999999996 110.176 179.459 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.424 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 32.5 t70 -60.34 -27.38 67.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.634 -0.712 . . . . 1.96 110.449 179.867 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 25.2 m -83.37 -25.38 31.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.273 0.558 . . . . 1.24 109.912 178.996 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -68.48 -35.2 77.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.481 -0.781 . . . . 3.7200000000000002 110.383 179.547 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 152' ' ' VAL . . . . . 0.509 HG22 ' HA2' ' A' ' 156' ' ' GLY . 12.2 p -78.79 -2.17 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.436 0.636 . . . . 1.8600000000000001 110.114 179.265 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 15.8 mm-40 -91.69 -18.02 24.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.809 -0.632 . . . . 1.6699999999999999 109.7 178.657 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 22.7 mt -106.58 -52.88 2.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.488 -0.778 . . . . 1.96 110.393 179.714 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -109.0 27.82 9.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.577 -0.738 . . . . 4.3899999999999997 110.943 -179.824 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 156' ' ' GLY . . . . . 0.509 ' HA2' HG22 ' A' ' 152' ' ' VAL . . . -46.78 152.46 1.32 Allowed Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.909 -0.587 . . . . 1.1000000000000001 113.683 -179.324 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 157' ' ' ASN . . . . . 0.468 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 21.5 t-20 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 115.624 -0.288 . . . . 1.29 110.661 179.719 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1005 ' ' GLY . . . . . 0.664 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.521 0.463 0 N-CA-C 112.858 -0.097 . . . . 1.26 112.858 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -110.11 -40.61 4.67 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.835 0.35 . . . . 3.4500000000000002 111.188 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -56.95 -76.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.008 -0.542 . . . . 1.54 112.22 -179.197 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1008 ' ' LEU . . . . . 0.44 ' H ' HD21 ' B' 1008 ' ' LEU . 3.3 mm? -50.99 -35.2 32.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 1.8999999999999999 111.846 -178.875 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B 1009 ' ' ALA . . . . . 0.54 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -62.8 -38.87 92.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.121 0.486 . . . . 1.45 110.977 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -79.95 -52.64 7.59 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.577 -0.738 . . . . 1.51 111.704 -179.306 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -60.31 -25.42 65.76 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.805 0.336 . . . . 2.0699999999999998 110.763 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.88 9.15 12.01 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 121.007 -0.616 . . . . 0.80000000000000004 112.787 -179.829 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 20.7 t70 -105.16 -5.15 20.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.988 0.423 . . . . 1.8999999999999999 110.405 179.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 5.1 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 115.862 -0.608 . . . . 1.4399999999999999 111.239 -179.585 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.9 tpt . . . . . 0 N--CA 1.481 1.098 0 CA-C-O 120.714 0.293 . . . . 6.4500000000000002 110.857 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.6 m -132.67 -59.81 0.89 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.515 -0.311 . . . . 2.2599999999999998 110.787 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.411 ' O ' ' HB3' ' A' ' 37' ' ' ALA . 24.1 mp0 -70.19 1.1 5.14 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.137 0.421 . . . . 2.7599999999999998 112.137 -177.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.2 m -65.17 -18.05 64.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.833 0.349 . . . . 1.54 110.815 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.551 ' HB2' HD13 ' A' ' 134' ' ' LEU . 4.9 p30 -59.0 -27.25 65.25 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.055 -0.521 . . . . 1.78 111.01 173.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.621 ' O ' HG21 ' A' ' 10' ' ' VAL . 8.7 tpp85 -58.93 -47.76 83.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.814 -0.63 . . . . 1.8999999999999999 110.278 177.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.569 ' OE1' ' HA2' ' A' ' 40' ' ' GLY . 44.9 mt-10 -54.46 -47.71 72.6 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 115.316 -0.857 . . . . 0.68000000000000005 110.867 -179.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.41 ' CD2' HG23 ' A' ' 46' ' ' VAL . 6.2 mt -57.77 -40.16 79.14 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.5 -1.227 . . . . 1.8 109.814 -173.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.4 t -67.53 -59.68 3.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.552 -0.749 . . . . 1.0700000000000001 110.196 174.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.621 HG21 ' O ' ' A' ' 6' ' ' ARG . 63.4 t -53.6 -50.86 47.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.117 -0.947 . . . . 1.1299999999999999 112.633 -174.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.6 -37.21 70.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.872 0.367 . . . . 0.58999999999999997 110.876 -176.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.693 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 35.3 t80 -73.6 -47.18 42.31 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 116.297 -0.41 . . . . 2.02 110.793 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.862 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.7 mp -59.13 -38.04 78.67 Favored 'General case' 0 C--O 1.228 -0.075 0 C-N-CA 120.249 -0.58 . . . . 1.0600000000000001 109.797 178.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.413 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 26.3 m -55.27 -50.42 69.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 1.6000000000000001 110.853 175.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -64.62 -32.06 73.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.003 -0.544 . . . . 1.49 110.461 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.603 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 7.6 mmpt? -63.94 -43.99 94.21 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 115.974 -0.557 . . . . 1.8400000000000001 111.353 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.625 HD21 ' O ' ' A' ' 13' ' ' LEU . 0.4 OUTLIER -71.55 -30.2 65.61 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 120.178 -0.609 . . . . 1.98 110.079 178.633 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.6 t -60.81 -40.23 91.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.638 -0.71 . . . . 1.3799999999999999 111.24 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -78.91 0.3 27.9 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.959 0.409 . . . . 1.51 112.014 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.679 ' HE2' HG13 ' A' ' 112' ' ' VAL . 19.0 mmmt -111.6 -27.08 8.71 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.899 0.857 . . . . 2.6499999999999999 109.123 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.79 20.29 11.87 Favored Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 114.097 -1.411 . . . . 0.54000000000000004 111.663 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -108.18 167.38 10.05 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.37 -0.604 . . . . 1.1200000000000001 109.37 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.425 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 3.9 t -110.42 144.42 39.24 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 121.084 0.468 . . . . 0.75 110.359 176.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.452 ' O ' ' HB3' ' A' ' 28' ' ' SER . 0.8 OUTLIER -74.44 -48.36 28.0 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.53 -0.759 . . . . 4.29 109.787 175.06 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.449 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 2.5 p -66.19 -31.46 72.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.035 -0.53 . . . . 1.8600000000000001 111.92 -173.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.425 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 89.9 mt-30 -61.71 -25.33 67.36 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.259 0.552 . . . . 1.52 111.148 177.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -121.35 17.64 11.42 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.559 -0.746 . . . . 1.53 111.058 -176.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.551 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 54.1 p -100.24 -178.13 3.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.484 0.659 . . . . 2.04 112.415 -171.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.613 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 6.7 t70 -171.97 -23.81 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.378 -1.283 . . . . 2.3100000000000001 109.069 -178.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.65 HG23 ' H ' ' A' ' 31' ' ' GLU . 7.1 m -47.17 -70.83 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 114.274 -1.33 . . . . 1.4099999999999999 112.643 -174.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.65 ' H ' HG23 ' A' ' 30' ' ' VAL . 8.7 pt-20 -100.6 1.16 40.5 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.53 0.681 . . . . 2.7400000000000002 109.245 175.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.613 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 31.1 tt0 -68.13 -53.88 22.12 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.814 -1.085 . . . . 1.45 110.894 -176.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.2 m-80 -101.17 -28.93 12.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.962 -0.563 . . . . 1.8700000000000001 111.286 -175.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.544 ' O ' ' HA ' ' A' ' 31' ' ' GLU . 15.0 ptp180 -125.39 149.07 48.5 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.683 -0.488 . . . . 3.8199999999999998 109.683 177.105 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.7 p -104.8 107.95 19.18 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.554 0.693 . . . . 2.6699999999999999 111.28 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -89.7 -80.51 0.31 Allowed 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.066 -0.97 . . . . 3.3399999999999999 109.83 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.411 ' HB3' ' O ' ' A' ' 3' ' ' GLN . . . -102.66 157.32 33.95 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 115.715 -0.675 . . . . 2.4399999999999999 110.911 177.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.805 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 50.2 Cg_exo -58.01 -175.82 0.07 OUTLIER 'Trans proline' 0 CA--C 1.533 0.454 0 C-N-CA 123.401 2.734 . . . . 1.8700000000000001 113.003 172.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -80.11 -10.51 59.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.412 0.625 . . . . 4.6399999999999997 110.485 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.569 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 166.53 63.24 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.646 -0.706 . . . . 2.3999999999999999 111.748 178.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.806 HG21 ' H ' ' A' ' 42' ' ' GLU . 0.8 OUTLIER -67.78 -75.5 0.1 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 120.724 -0.39 . . . . 1.45 110.488 -175.16 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.806 ' H ' HG21 ' A' ' 41' ' ' THR . 15.2 pt-20 -93.68 -31.94 14.25 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 122.343 1.068 . . . . 2.02 108.935 170.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.892 ' HA ' HG13 ' A' ' 46' ' ' VAL . 66.6 m -59.17 -25.91 64.33 Favored 'General case' 0 C--O 1.209 -1.027 0 CA-C-N 113.315 -1.766 . . . . 1.25 113.496 -170.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -43.96 -38.89 3.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 118.131 0.423 . . . . 1.9099999999999999 111.56 -177.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.06 -42.35 14.02 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.567 0.21 . . . . 1.1799999999999999 111.567 174.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.892 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.6 m -68.33 -41.92 83.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 120.908 -0.317 . . . . 2.0099999999999998 111.796 -175.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.785 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.0 ptpt -68.4 -36.26 78.85 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.154 -0.684 . . . . 1.3799999999999999 109.154 178.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.51 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 5.1 mm100 -61.16 -36.52 80.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.587 -0.733 . . . . 0.98999999999999999 111.405 174.064 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.569 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -75.7 -40.66 55.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.673 0.749 . . . . 1.1399999999999999 110.177 175.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.55 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -56.65 -40.71 75.94 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.722 -1.126 . . . . 1.95 112.113 -178.92 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 7.5 ptp180 -75.44 -29.89 59.84 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.774 0.797 . . . . 2.5099999999999998 109.617 -169.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 32.9 mm-40 -72.51 -48.3 41.63 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.283 -1.326 . . . . 1.1000000000000001 109.852 179.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.57 -36.99 85.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.557 -0.747 . . . . 1.04 110.355 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.572 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -61.89 -42.36 99.73 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.912 -0.585 . . . . 0.69999999999999996 111.782 176.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -58.64 -42.98 89.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.005 0.431 . . . . 1.04 110.517 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -57.41 -28.26 63.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.394 -0.821 . . . . 2.29 111.239 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.489 ' HD2' ' HB3' ' A' ' 105' ' ' SER . 17.2 t80 -82.2 -39.4 23.18 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.221 -0.445 . . . . 2.9300000000000002 110.983 178.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.687 ' HA ' ' CE2' ' A' ' 61' ' ' TYR . 40.2 mt-10 -60.52 -63.69 1.21 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.138 -0.483 . . . . 1.3 112.21 -168.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.598 HD11 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -49.64 -37.46 28.35 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 123.673 0.608 . . . . 2.1899999999999999 112.342 -178.399 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.598 ' H ' HD11 ' A' ' 59' ' ' LEU . 63.6 mtt180 -63.6 -44.54 93.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.172 -0.467 . . . . 3.1400000000000001 111.728 -177.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.687 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 5.5 p90 -90.95 -7.81 51.03 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 120.654 -0.418 . . . . 5.5899999999999999 111.506 -179.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -58.28 -26.0 62.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 4.9299999999999997 111.385 -174.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -55.87 -46.26 78.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.046 -0.525 . . . . 5.3499999999999996 110.937 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.689 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.85 -32.7 15.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.409 -0.36 . . . . 1.7 111.498 -178.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.68 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 47.5 t80 -42.91 -46.92 5.54 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.735 1.013 . . . . 3.52 113.735 -171.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.2 p -68.13 -27.53 66.52 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.92 0.391 . . . . 2.5899999999999999 111.608 -175.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -90.42 -29.21 18.14 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.023 -0.535 . . . . 2.7200000000000002 111.552 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.689 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 65.1 mt -66.48 -17.77 64.99 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.894 0.702 . . . . 2.25 112.894 -171.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.626 HG21 HG13 ' A' ' 74' ' ' ILE . 8.6 p -61.24 -24.77 66.6 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.429 0.633 . . . . 1.26 110.694 -176.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.0 m -74.95 -29.71 61.01 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.847 -1.069 . . . . 1.8 110.501 176.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.758 HE22 ' HB2' ' B' 1003 ' ' CYS . 12.6 mt-30 -82.0 -49.47 10.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.475 -0.784 . . . . 1.8899999999999999 110.504 -177.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.685 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.7 mp -66.17 -28.77 69.03 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.086 -0.709 . . . . 1.98 109.086 176.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 67.9 t60 64.45 55.26 1.39 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 122.244 1.021 . . . . 3.54 108.253 -176.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.626 HG13 HG21 ' A' ' 69' ' ' THR . 15.5 mm -57.42 112.04 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 113.628 -1.624 . . . . 1.1499999999999999 110.666 -178.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.785 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.5 -167.45 0.16 Allowed Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 107.424 -1.324 . . . . 1.1200000000000001 107.424 -169.12 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.785 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.0 Cg_exo -29.03 165.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.303 0 C-N-CA 124.636 3.558 . . . . 0.53000000000000003 115.037 162.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -34.61 -24.63 0.01 OUTLIER Glycine 0 N--CA 1.474 1.208 0 N-CA-C 117.221 1.648 . . . . 0.40999999999999998 117.221 -171.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 76' ' ' PRO . 40.1 p -69.1 3.37 2.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 117.956 0.878 . . . . 1.22 112.096 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.11 -14.15 62.2 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.274 0.559 . . . . 1.0700000000000001 109.961 173.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -78.12 -15.82 58.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.567 . . . . 4.3099999999999996 109.543 176.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.48 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 36.5 mt-30 -87.87 -22.62 24.32 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.801 0.81 . . . . 1.03 109.672 173.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.517 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 5.8 m -72.35 -48.71 39.67 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.617 -1.174 . . . . 0.47999999999999998 109.293 170.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.408 ' O ' HG11 ' A' ' 86' ' ' VAL . 84.8 t80 -70.69 -15.59 62.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.021 -0.991 . . . . 1.4399999999999999 110.047 173.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.655 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.1 tt0 -64.7 -49.07 72.35 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.167 0.508 . . . . 0.80000000000000004 110.276 175.334 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -43.07 -44.8 5.02 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.525 -1.216 . . . . 1.99 111.318 178.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.944 ' HA ' ' HA2' ' B' 1005 ' ' GLY . 0.9 OUTLIER -86.15 -44.53 16.74 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.335 0 CA-C-N 113.835 -1.53 . . . . 1.8999999999999999 111.829 -172.645 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.655 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.8 p -62.23 -23.53 32.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.98 0.895 . . . . 1.4299999999999999 109.876 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.73 -48.52 74.31 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.357 -1.292 . . . . 0.91000000000000003 110.917 176.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.704 ' HB3' ' HB1' ' B' 1009 ' ' ALA . 5.6 mm-40 -69.15 -43.56 74.06 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-O 122.443 1.116 . . . . 2.8700000000000001 108.815 178.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.589 ' HG ' ' NH1' ' A' ' 99' ' ' ARG . 8.4 tp -54.86 -24.98 25.71 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 112.312 -2.222 . . . . 1.9199999999999999 111.518 -173.312 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.495 ' O ' HG22 ' A' ' 95' ' ' VAL . 76.1 t80 -100.04 -35.67 9.62 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.637 0.732 . . . . 2.9700000000000002 110.935 -173.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.526 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 7.5 ptm180 -77.82 -35.26 51.5 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.502 -0.772 . . . . 5.6699999999999999 111.42 -172.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -93.22 20.64 6.74 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.411 -0.813 . . . . 3.1200000000000001 112.753 -169.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.582 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 128.02 68.59 0.14 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 117.167 -2.444 . . . . 2.3100000000000001 115.935 174.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.548 HG23 HH21 ' A' ' 99' ' ' ARG . 67.8 t -73.31 98.43 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 118.649 1.225 . . . . 1.6799999999999999 111.611 177.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.409 ' ND2' ' N ' ' A' ' 96' ' ' ASN . 1.0 OUTLIER -112.45 -170.78 1.73 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.327 -1.306 . . . . 2.1200000000000001 108.996 179.582 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.752 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 22.5 m-90 -63.63 -63.54 1.14 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.9 0.381 . . . . 4.1200000000000001 110.666 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.411 ' O ' HG21 ' A' ' 101' ' ' VAL . . . -67.11 -26.66 73.35 Favored Glycine 0 C--O 1.225 -0.411 0 CA-C-N 115.933 -0.576 . . . . 0.80000000000000004 112.723 -177.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.608 ' HD2' ' O ' ' A' ' 99' ' ' ARG . 1.7 tmm_? -58.23 -40.16 80.95 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.936 0.398 . . . . 4.9100000000000001 110.268 178.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 52.6 mt -67.8 -28.18 40.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.522 -0.308 . . . . 1.1100000000000001 111.656 -175.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.502 HG21 HD12 ' B' 1015 ' ' ILE . 0.8 OUTLIER -64.03 -25.88 39.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.308 0.575 . . . . 2.0299999999999998 110.079 176.472 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.479 ' HA ' ' CD2' ' A' ' 57' ' ' PHE . . . -66.94 -39.79 87.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.735 0.779 . . . . 1.0600000000000001 110.327 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.442 ' HB2' HH12 ' A' ' 99' ' ' ARG . 28.0 t80 -64.0 -46.17 85.74 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.366 -1.288 . . . . 1.8400000000000001 110.914 -178.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.589 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.1 OUTLIER -80.36 -18.69 48.29 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.529 -0.468 . . . . 4.21 110.553 -178.283 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.693 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 35.3 t -75.17 -57.5 3.85 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.383 -0.371 . . . . 1.55 110.59 178.369 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -68.3 -24.19 64.82 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 109.498 -0.556 . . . . 3.6400000000000001 109.498 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.524 ' HA3' ' HE2' ' A' ' 130' ' ' MET . . . -67.12 -42.3 91.8 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.69 -0.767 . . . . 0.32000000000000001 111.467 172.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.862 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.82 -31.29 79.28 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.66 -0.781 . . . . 0.23999999999999999 111.396 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.68 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -75.2 -33.05 61.37 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.69 -0.255 . . . . 1.05 110.553 176.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.42 HD12 HD11 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -59.48 -39.4 83.62 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 107.956 -1.127 . . . . 1.78 107.956 179.173 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.733 ' SG ' HG21 ' A' ' 123' ' ' VAL . 29.9 t -49.57 -62.92 1.28 Allowed 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 113.368 -1.742 . . . . 0.90000000000000002 110.204 172.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.732 ' HA ' HG12 ' A' ' 115' ' ' VAL . 46.8 t -63.18 -34.54 67.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.384 -0.371 . . . . 1.2 111.48 -176.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.621 ' HB3' HG22 ' A' ' 74' ' ' ILE . 36.7 mt-10 -55.91 -25.32 42.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.097 0.475 . . . . 2.5099999999999998 110.418 176.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.429 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 65.0 m -85.0 -41.46 15.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.485 -0.931 . . . . 0.28000000000000003 108.485 -178.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.732 HG12 ' HA ' ' A' ' 112' ' ' VAL . 1.4 m -69.14 -29.74 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.349 0 CA-C-N 114.734 -1.121 . . . . 1.8300000000000001 109.422 -177.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -51.31 -51.03 58.01 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.205 -1.816 . . . . 0.59999999999999998 111.563 175.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.473 ' CG ' ' HE3' ' A' ' 119' ' ' MET . 13.2 mmtp -83.52 10.59 8.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.724 -0.671 . . . . 2.1600000000000001 109.743 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.588 ' HA ' ' NE2' ' A' ' 120' ' ' GLN . 36.0 mt-10 63.31 55.82 1.79 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 122.159 0.981 . . . . 1.8799999999999999 109.805 -176.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.473 ' HE3' ' CG ' ' A' ' 117' ' ' LYS . 24.6 mtm -134.96 37.36 3.04 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.848 -1.524 . . . . 1.0800000000000001 107.553 179.054 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.678 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 4.9 mp0 -52.28 -7.36 0.06 Allowed 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 114.903 -1.044 . . . . 1.1499999999999999 113.353 -178.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.464 HG23 HD21 ' A' ' 122' ' ' LEU . 27.0 m -67.41 -22.41 28.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 121.464 -0.773 . . . . 1.1899999999999999 111.921 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.698 HD11 ' HD2' ' A' ' 125' ' ' ARG . 3.5 mm? -71.6 -24.77 61.95 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.014 0.435 . . . . 1.0600000000000001 109.928 178.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.733 HG21 ' SG ' ' A' ' 111' ' ' CYS . 42.3 t -44.92 -49.38 2.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 114.716 -1.129 . . . . 1.0 112.593 -177.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.551 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 8.9 t -78.22 -34.83 49.07 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.44 -0.504 . . . . 1.6599999999999999 110.58 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.698 ' HD2' HD11 ' A' ' 122' ' ' LEU . 66.5 mtt180 -62.85 -49.27 75.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.002 -0.545 . . . . 3.2999999999999998 110.418 -176.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.56 HD12 ' HA ' ' A' ' 111' ' ' CYS . 73.6 mt -57.82 -52.19 60.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.488 -0.778 . . . . 1.0600000000000001 110.767 178.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.746 ' HB1' HD21 ' A' ' 13' ' ' LEU . . . -54.07 -36.68 63.4 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 123.291 0.37 . . . . 1.1000000000000001 111.339 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.46 -56.13 23.54 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.357 0.599 . . . . 1.1200000000000001 111.054 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -72.57 -23.7 61.0 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.225 -0.898 . . . . 4.7699999999999996 111.627 -174.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.543 ' SD ' HG22 ' A' ' 126' ' ' ILE . 88.8 mtp -66.01 -58.72 4.87 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.1 0.476 . . . . 1.0900000000000001 110.343 174.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.96 -35.65 79.09 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.704 -0.68 . . . . 1.05 110.702 -178.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.6 m -63.47 -46.7 84.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.411 -0.359 . . . . 1.1299999999999999 110.95 176.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -56.69 -39.12 73.25 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.858 -0.423 . . . . 3.3500000000000001 109.858 177.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.931 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.9 tt -62.77 -50.98 68.9 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.985 -0.746 . . . . 1.5900000000000001 108.985 174.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -51.46 -49.54 61.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.673 0.62 . . . . 0.46000000000000002 112.673 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -83.15 -51.29 7.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.041 0.448 . . . . 0.58999999999999997 112.103 -176.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -91.4 -50.46 5.79 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 113.121 0.786 . . . . 2.3399999999999999 113.121 -170.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.931 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -80.61 -45.05 17.93 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.564 0.95 . . . . 1.8999999999999999 113.564 -168.323 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.656 ' HA ' HD13 ' A' ' 142' ' ' ILE . 28.1 tt0 -47.47 -50.4 49.82 Favored Pre-proline 0 C--N 1.322 -0.612 0 O-C-N 123.686 0.616 . . . . 0.75 112.526 -175.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.555 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 51.8 Cg_exo -52.99 -50.26 14.69 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 121.746 1.63 . . . . 0.87 111.734 176.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -58.83 -48.16 82.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.587 -0.733 . . . . 1.4299999999999999 110.513 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.656 HD13 ' HA ' ' A' ' 139' ' ' GLU . 43.9 mt -49.92 -50.96 17.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.058 -0.519 . . . . 1.1299999999999999 111.351 176.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.57 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 79.2 mm-40 -60.21 -31.45 70.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.559 -0.746 . . . . 0.57999999999999996 111.587 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.7 mm-40 -65.41 -20.71 66.49 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 121.519 0.676 . . . . 0.78000000000000003 110.685 177.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.403 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 18.1 m-80 -111.47 5.84 19.83 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.088 -0.96 . . . . 0.93000000000000005 110.371 -174.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.01 -47.08 1.06 Allowed Glycine 0 N--CA 1.441 -1.006 0 CA-C-N 115.318 -0.855 . . . . 0.56000000000000005 113.294 173.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . 0.542 ' HA2' HG21 ' A' ' 142' ' ' ILE . . . 130.16 -172.39 20.24 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.48 -0.867 . . . . 0.48999999999999999 112.064 -177.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 9.0 m-90 -76.08 -35.5 59.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.529 0.204 . . . . 4.5199999999999996 110.742 -177.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -59.1 -43.94 91.91 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.176 0.512 . . . . 1.96 109.702 175.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.575 ' O ' HD12 ' A' ' 154' ' ' LEU . 95.8 m -60.1 -34.48 73.54 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.29 -0.868 . . . . 1.24 111.021 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.752 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 90.0 t80 -60.68 -41.44 95.09 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.482 -0.487 . . . . 3.7200000000000002 110.212 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.541 HG11 ' HA ' ' A' ' 46' ' ' VAL . 1.5 m -76.03 -26.94 17.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.916 0.389 . . . . 1.8600000000000001 110.486 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 150' ' ' THR . 7.8 mm-40 -56.0 -47.95 76.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.342 0.592 . . . . 1.6699999999999999 109.56 170.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.575 HD12 ' O ' ' A' ' 150' ' ' THR . 7.4 mp -78.25 -61.25 2.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.2 -0.909 . . . . 1.96 112.902 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -120.83 29.64 7.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.303 0.573 . . . . 4.3899999999999997 110.423 -168.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.569 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -58.92 166.19 7.89 Favored Glycine 0 CA--C 1.506 -0.473 0 CA-C-N 115.476 -0.784 . . . . 1.1000000000000001 114.115 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.456 ' ND2' HE21 ' A' ' 48' ' ' GLN . 26.9 t-20 -56.37 110.07 0.71 Allowed 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 113.835 -1.182 . . . . 1.29 111.038 -179.054 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.577 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 7.4 t30 -81.86 -16.56 50.33 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 116.31 -0.404 . . . . 3.4399999999999999 110.378 -174.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.01 -51.68 69.02 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.656 -0.498 . . . . 2.6699999999999999 109.656 172.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -67.15 -32.51 73.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.631 -0.713 . . . . 2.8700000000000001 110.243 175.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 0.577 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -57.46 -52.05 66.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.709 -0.678 . . . . 3.2000000000000002 110.49 176.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 158' ' ' ASN . 42.4 mt-10 -67.92 -31.5 71.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.249 -0.432 . . . . 3.7200000000000002 110.732 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 36.2 t -58.1 -46.34 85.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.063 -0.517 . . . . 4.2000000000000002 110.624 178.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -87.21 -16.01 36.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.915 0.388 . . . . 6.3700000000000001 111.402 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -67.32 -29.67 69.31 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.836 -0.62 . . . . 5.0099999999999998 110.613 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -55.68 -56.71 22.36 Favored Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 115.913 -0.585 . . . . 5.0999999999999996 112.518 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -75.6 -23.75 56.49 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.927 0.394 . . . . 5.9400000000000004 111.012 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -72.96 -12.26 60.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.019 0.438 . . . . 5.8799999999999999 109.917 179.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.616 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 0.1 OUTLIER -72.67 -31.46 65.08 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.74 -0.837 . . . . 7.7999999999999998 108.74 179.137 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -84.74 -12.46 53.69 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.249 -0.887 . . . . 7.29 109.803 176.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . 0.625 ' HB3' ' CD2' ' A' ' 173' ' ' HIS . 46.2 mt-10 65.87 104.81 0.04 OUTLIER 'General case' 0 C--O 1.23 0.076 0 CA-C-N 115.116 -0.947 . . . . 6.9699999999999998 110.779 -177.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -82.08 -38.2 25.25 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.472 -0.491 . . . . 9.8100000000000005 110.692 -177.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . 0.625 ' CD2' ' HB3' ' A' ' 171' ' ' GLU . 91.3 m-70 48.19 -157.84 0.06 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.442 -0.345 . . . . 11.99 111.494 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 64.5 m80 64.47 21.41 12.45 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.058 -0.519 . . . . 11.949999999999999 111.183 174.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -115.22 105.07 12.47 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.211 -0.449 . . . . 14.949999999999999 110.702 -177.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -106.54 157.09 17.93 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.474 -0.565 . . . . 15.880000000000001 109.474 177.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 49.5 p-80 -130.14 128.25 41.41 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.271 0.557 . . . . 16.02 111.331 -177.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 78.3 mt -106.33 -1.35 23.47 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.036 -0.728 . . . . 18.210000000000001 109.036 174.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -83.35 148.98 27.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.114 -0.948 . . . . 19.219999999999999 110.364 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 32.0 m80 -127.67 96.91 4.67 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.321 -0.4 . . . . 22.800000000000001 110.961 178.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 59.0 m80 65.76 -174.92 0.18 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.771 -0.649 . . . . 22.510000000000002 111.912 177.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -89.17 122.24 32.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.563 -0.744 . . . . 25.300000000000001 109.311 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -93.22 155.64 17.32 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.767 0.317 . . . . 25.77 110.66 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 48.1 p-80 -124.63 173.71 8.34 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.125 -0.489 . . . . 27.370000000000001 110.29 -178.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 11.1 p80 . . . . . 0 C--O 1.247 0.965 0 CA-C-N 116.315 -0.402 . . . . 29.52 110.354 178.751 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.263 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . 116.57 163.58 13.36 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 121.006 -0.616 . . . . 2.9900000000000002 112.004 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.758 ' HB2' HE22 ' A' ' 71' ' ' GLN . 16.4 m 65.1 -140.32 0.22 Allowed 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 122.375 0.27 . . . . 1.9399999999999999 110.848 178.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.479 ' CG1' HD12 ' A' ' 68' ' ' LEU . 2.9 m 40.86 -79.3 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.345 0.374 0 C-N-CA 125.4 1.48 . . . . 1.9399999999999999 114.442 175.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 0.944 ' HA2' ' HA ' ' A' ' 86' ' ' VAL . . . -43.51 -62.19 2.59 Favored Glycine 0 N--CA 1.435 -1.405 0 C-N-CA 119.163 -1.494 . . . . 1.26 110.287 168.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -61.08 -42.16 97.99 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.932 0.345 . . . . 3.4500000000000002 111.932 177.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -70.91 -49.5 45.1 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.342 0.497 . . . . 1.54 112.342 -171.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.599 ' HB2' HG23 ' A' ' 86' ' ' VAL . 2.1 mm? -73.82 -34.93 64.78 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.055 -0.258 . . . . 1.8999999999999999 110.425 -178.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 0.704 ' HB1' ' HB3' ' A' ' 89' ' ' GLU . . . -47.22 -47.52 24.47 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.983 0.897 . . . . 1.45 110.377 168.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.833 ' HB2' ' N11' ' B' 1100 ' ' 33B . . . -79.82 -58.42 3.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 114.026 -1.443 . . . . 1.51 111.881 -174.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.534 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 37.5 m-85 -61.65 -19.21 62.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 2.0699999999999998 111.15 -178.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.92 -25.08 72.52 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 121.033 -0.603 . . . . 0.80000000000000004 113.106 -178.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 31.1 t70 -77.05 5.83 7.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.411 0.624 . . . . 1.8999999999999999 110.513 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 35.3 m -101.5 4.62 41.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.028 -0.533 . . . . 1.4399999999999999 111.092 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.502 HD12 HG21 ' A' ' 101' ' ' VAL . 55.4 mt -79.85 67.41 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 121.903 0.859 . . . . 3.4300000000000002 110.045 178.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 36.4 t-20 -178.26 -51.62 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.431 -1.259 . . . . 4.79 107.66 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -134.84 98.67 4.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.971 -1.013 . . . . 8.9800000000000004 110.059 175.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.66 0 CA-C-N 116.427 -0.351 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.833 ' N11' ' HB2' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.742 ' HE2' ' HA ' ' A' ' 1' ' ' MET . 13.3 mmt . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 109.667 -0.494 . . . . 6.4500000000000002 109.667 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.587 ' HB3' ' OD1' ' A' ' 135' ' ' ASN . 74.1 m -107.32 -37.12 6.33 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.001 0.429 . . . . 2.2599999999999998 111.369 179.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.423 ' O ' ' HB3' ' A' ' 6' ' ' ARG . 24.3 mp0 -70.74 -15.23 62.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.021 0.439 . . . . 2.7599999999999998 110.651 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.528 ' O ' ' HG ' ' A' ' 8' ' ' LEU . 5.1 p -68.7 -32.2 71.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.095 -0.502 . . . . 1.54 111.176 178.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.687 ' HA ' HD12 ' A' ' 8' ' ' LEU . 50.6 m-20 -62.15 -26.66 68.45 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.077 0.465 . . . . 1.78 110.127 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.594 ' O ' HG23 ' A' ' 10' ' ' VAL . 16.9 tpp85 -57.47 -49.36 76.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.491 -0.777 . . . . 1.8999999999999999 109.81 176.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.632 ' HG3' ' HB3' ' A' ' 37' ' ' ALA . 45.0 mt-10 -57.23 -44.99 84.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.528 -0.76 . . . . 0.68000000000000005 111.085 178.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.687 HD12 ' HA ' ' A' ' 5' ' ' ASN . 8.8 mt -60.65 -29.39 69.24 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.583 -1.189 . . . . 1.8 110.117 -174.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.546 HG22 ' N ' ' A' ' 131' ' ' ALA . 55.9 t -80.65 -59.62 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 115.05 -0.977 . . . . 1.0700000000000001 110.161 173.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 6' ' ' ARG . 99.4 t -52.28 -54.59 13.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.38 -0.827 . . . . 1.1299999999999999 112.466 -175.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -56.85 -35.86 69.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.996 0.427 . . . . 0.58999999999999997 110.355 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.513 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 8.2 t80 -72.38 -48.0 45.03 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.84 -0.618 . . . . 2.02 110.469 -178.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.824 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.5 mp -61.66 -42.21 98.6 Favored 'General case' 0 C--N 1.338 0.098 0 C-N-CA 120.793 -0.363 . . . . 1.0600000000000001 110.516 177.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.8 t -58.97 -45.52 90.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.12 -0.491 . . . . 1.6000000000000001 110.142 177.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -59.37 -33.83 71.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.469 -0.787 . . . . 1.49 110.936 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.672 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 8.6 mmpt? -75.96 -30.96 58.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.379 -0.373 . . . . 1.8400000000000001 111.932 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.541 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -70.25 -27.78 64.71 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.261 -0.576 . . . . 1.98 110.265 176.511 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -58.8 -43.41 90.54 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.879 -0.601 . . . . 1.3799999999999999 112.315 -178.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -72.45 -2.75 20.68 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.28 0.562 . . . . 1.51 111.551 -177.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.581 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 18.3 mmmt -109.64 -26.25 9.99 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.945 0.879 . . . . 2.6499999999999999 109.014 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.14 22.1 11.04 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 113.829 -1.532 . . . . 0.54000000000000004 111.171 178.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.581 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 95.1 m-85 -114.17 165.52 12.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.942 0.401 . . . . 1.1200000000000001 110.827 -179.036 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.8 t -110.92 141.33 44.48 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.758 -0.656 . . . . 0.75 109.906 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -65.72 -46.12 80.13 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.113 -0.494 . . . . 4.29 110.01 174.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.3 p -64.75 -36.52 84.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.748 -0.66 . . . . 1.8600000000000001 111.836 -172.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.69 -31.01 69.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.073 0.463 . . . . 1.52 111.24 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.527 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 15.8 m-85 -112.54 13.54 20.08 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.892 -0.594 . . . . 1.53 110.441 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.562 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 79.8 p -96.76 -179.29 4.53 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 121.69 0.757 . . . . 2.04 111.511 -176.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.511 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.2 t70 -164.86 -26.06 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.98 -1.464 . . . . 2.3100000000000001 107.753 -177.389 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.614 HG21 ' H ' ' A' ' 31' ' ' GLU . 8.9 m -59.81 -75.11 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 113.734 -1.575 . . . . 1.4099999999999999 112.331 -177.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.614 ' H ' HG21 ' A' ' 30' ' ' VAL . 12.3 mm-40 -80.72 -7.87 59.49 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.618 -0.882 . . . . 2.7400000000000002 108.618 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.511 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 25.2 tt0 -66.11 -44.94 82.86 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.174 -1.376 . . . . 1.45 110.528 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -102.74 -49.72 3.74 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.944 -0.571 . . . . 1.8700000000000001 111.917 -175.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.469 ' HG2' ' O ' ' A' ' 30' ' ' VAL . 12.7 ptp180 -94.76 155.28 16.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.925 0.393 . . . . 3.8199999999999998 110.74 -178.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 31.9 p -125.44 115.02 19.6 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.996 -0.547 . . . . 2.6699999999999999 110.365 176.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -137.15 -69.27 0.46 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.61 -0.723 . . . . 3.3399999999999999 110.461 -178.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.632 ' HB3' ' HG3' ' A' ' 7' ' ' GLU . . . -60.07 133.33 90.07 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 115.244 -0.889 . . . . 2.4399999999999999 111.86 -179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.764 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 17.4 Cg_exo -68.3 -171.54 0.37 Allowed 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 124.032 3.155 . . . . 1.8700000000000001 112.005 176.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -90.57 13.06 16.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.484 0.659 . . . . 4.6399999999999997 110.397 177.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 134.4 66.19 0.07 OUTLIER Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.347 -0.842 . . . . 2.3999999999999999 111.225 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.829 HG21 ' H ' ' A' ' 42' ' ' GLU . 1.3 t -69.09 -76.97 0.09 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 120.756 -0.378 . . . . 1.45 110.725 -174.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.829 ' H ' HG21 ' A' ' 41' ' ' THR . 15.9 pt-20 -95.56 -26.5 15.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.589 1.185 . . . . 2.02 108.762 167.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.755 ' HB2' ' HE3' ' A' ' 47' ' ' LYS . 1.4 p -55.78 -39.67 71.57 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 112.407 -2.179 . . . . 1.25 114.56 -169.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -39.66 -53.74 2.13 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.895 0.747 . . . . 1.9099999999999999 112.792 -169.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.15 -36.24 58.86 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.94 0.348 . . . . 1.1799999999999999 111.94 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.655 ' HB ' ' HB3' ' A' ' 148' ' ' TRP . 0.8 OUTLIER -69.98 -44.88 78.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 121.012 -0.275 . . . . 2.0099999999999998 110.888 -176.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.755 ' HE3' ' HB2' ' A' ' 43' ' ' SER . 18.1 ptpt -64.16 -41.28 97.22 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.422 -0.584 . . . . 1.3799999999999999 109.422 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.682 HE21 ' HA ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -56.89 -34.93 68.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.357 -0.838 . . . . 0.98999999999999999 111.545 174.296 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.703 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -78.61 -33.86 47.11 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.234 0.54 . . . . 1.1399999999999999 110.501 178.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 12.5 mt -63.38 -33.66 76.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.484 -0.78 . . . . 1.95 112.306 -177.165 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.649 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.3 ptp180 -79.49 -29.25 41.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.592 0.71 . . . . 2.5099999999999998 109.178 -174.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -70.27 -43.78 69.77 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.29 -1.323 . . . . 1.1000000000000001 110.655 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.28 -43.68 69.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.823 -0.626 . . . . 1.04 110.526 176.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.632 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.66 -39.09 96.1 Favored Glycine 0 C--O 1.226 -0.346 0 CA-C-N 115.852 -0.613 . . . . 0.69999999999999996 111.815 178.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -53.59 -43.58 68.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.024 0.44 . . . . 1.04 110.463 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.665 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 37.5 mt-10 -69.97 -38.4 76.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.891 -0.595 . . . . 2.29 111.268 177.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.52 ' HE2' ' CZ ' ' A' ' 106' ' ' PHE . 7.3 t80 -65.16 -33.0 74.98 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.363 -0.381 . . . . 2.9300000000000002 110.773 -174.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.632 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 33.6 mt-10 -65.35 -47.14 77.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.16 -0.473 . . . . 1.3 110.793 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.665 ' HG ' ' O ' ' A' ' 56' ' ' GLU . 4.6 pp -68.67 -31.26 70.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 2.1899999999999999 110.638 -179.28 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.694 ' HB3' ' SG ' ' B' 1014 ' ' CYS . 47.3 mtt180 -68.77 -35.94 77.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.586 0.708 . . . . 3.1400000000000001 110.186 178.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.683 ' HB3' ' HB3' ' A' ' 65' ' ' PHE . 0.2 OUTLIER -91.5 0.04 57.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.925 -1.034 . . . . 5.5899999999999999 112.089 -177.718 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -35.81 -39.44 0.15 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.125 1.158 . . . . 4.9299999999999997 114.125 -172.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.5 ' NH1' ' O71' ' B' 1100 ' ' 33B . 34.6 ttm180 -75.46 -42.98 51.9 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 122.181 -0.324 . . . . 5.3499999999999996 111.7 -175.289 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.532 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -91.91 -41.19 10.73 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.786 0.661 . . . . 1.7 112.786 -174.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.683 ' HB3' ' HB3' ' A' ' 61' ' ' TYR . 5.5 p90 -49.49 -40.71 38.39 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.524 0.935 . . . . 3.52 113.524 -164.12 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.5 t -91.03 -42.36 10.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.934 0.397 . . . . 2.5899999999999999 110.39 -177.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -59.2 -28.64 66.83 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.619 0.723 . . . . 2.7200000000000002 110.955 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.647 ' O ' HD12 ' A' ' 72' ' ' LEU . 1.8 mp -62.42 -17.06 58.41 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.029 -0.987 . . . . 2.25 113.263 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.725 HG22 HG13 ' A' ' 74' ' ' ILE . 12.6 p -62.65 -22.9 66.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 118.397 0.544 . . . . 1.26 112.058 -175.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.7 t -76.15 -35.14 59.35 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.017 -0.735 . . . . 1.8 109.017 174.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.494 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 9.0 mt-30 -69.2 -47.41 64.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.816 -1.084 . . . . 1.8899999999999999 109.785 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.647 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mt -70.53 -32.02 69.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.602 -0.726 . . . . 1.98 110.109 177.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 60.74 63.95 1.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.999 0.904 . . . . 3.54 108.861 -172.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.725 HG13 HG22 ' A' ' 69' ' ' THR . 29.3 mm -60.64 115.05 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 114.006 -1.452 . . . . 1.1499999999999999 111.382 -178.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.773 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -155.58 -172.26 0.31 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 107.963 -1.125 . . . . 1.1200000000000001 107.963 -171.463 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.773 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 17.8 Cg_exo -31.05 167.36 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.327 0 C-N-CA 125.029 3.819 . . . . 0.53000000000000003 115.091 165.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.487 ' N ' HD12 ' A' ' 122' ' ' LEU . . . -29.85 -27.16 0.01 OUTLIER Glycine 0 N--CA 1.476 1.331 0 N-CA-C 117.372 1.709 . . . . 0.40999999999999998 117.372 -174.176 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.458 ' N ' ' O ' ' A' ' 76' ' ' PRO . 24.9 p -68.48 -0.36 4.92 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 117.909 0.855 . . . . 1.22 111.925 177.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.32 -14.75 62.72 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.295 0.569 . . . . 1.0700000000000001 109.621 170.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -73.33 -25.99 60.85 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.577 -0.738 . . . . 4.3099999999999996 109.553 173.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.43 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 78.2 mt-30 -80.71 -31.98 35.94 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.902 0.858 . . . . 1.03 109.092 177.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.3 m -63.62 -54.21 39.43 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.015 -1.448 . . . . 0.47999999999999998 110.005 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.54 ' HA ' HG23 ' A' ' 86' ' ' VAL . 79.7 t80 -70.41 -18.49 63.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.365 -0.834 . . . . 1.4399999999999999 110.717 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.596 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.6 tt0 -59.21 -50.25 74.76 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.692 -0.686 . . . . 0.80000000000000004 110.46 176.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.546 ' OE1' HG22 ' B' 1004 ' ' VAL . 80.5 mt-30 -47.62 -32.45 5.57 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.596 -1.184 . . . . 1.99 110.769 175.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 1.019 HG12 ' HG ' ' B' 1008 ' ' LEU . 1.6 t -84.1 -54.7 8.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-N 114.552 -1.203 . . . . 1.8999999999999999 110.879 -176.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.596 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.3 p -60.69 -29.65 45.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.83 -0.623 . . . . 1.4299999999999999 109.989 -176.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.72 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 0.7 OUTLIER -58.22 -50.09 74.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.758 -1.11 . . . . 0.91000000000000003 110.687 175.929 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 1.004 ' HB3' ' HB2' ' B' 1009 ' ' ALA . 35.7 mm-40 -64.26 -42.79 96.32 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 122.331 1.062 . . . . 2.8700000000000001 109.391 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.519 HD11 ' HA ' ' A' ' 90' ' ' LEU . 0.3 OUTLIER -58.14 -25.48 61.49 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 112.692 -2.049 . . . . 1.9199999999999999 112.814 -165.906 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.581 ' HA ' HG22 ' A' ' 95' ' ' VAL . 15.9 p90 -106.28 -22.15 12.91 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.62 -0.432 . . . . 2.9700000000000002 112.071 -174.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.72 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.7 OUTLIER -94.24 -29.59 15.01 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-O 121.257 0.551 . . . . 5.6699999999999999 111.298 -175.557 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.551 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 37.6 t70 -90.31 7.48 38.19 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.637 -0.71 . . . . 3.1200000000000001 112.685 -168.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 129.59 70.63 0.12 Allowed Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 117.125 -2.464 . . . . 2.3100000000000001 114.345 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.581 HG22 ' HA ' ' A' ' 91' ' ' PHE . 48.6 t -71.65 101.52 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 122.399 1.095 . . . . 1.6799999999999999 111.302 -179.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.411 ' H ' ' CB ' ' A' ' 99' ' ' ARG . 0.7 OUTLIER -111.47 -179.87 3.83 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 113.745 -1.57 . . . . 2.1200000000000001 108.293 177.877 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.573 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 5.1 m95 -60.93 -52.43 65.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.81 0.338 . . . . 4.1200000000000001 111.002 177.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.461 ' HA3' HG22 ' B' 1015 ' ' ILE . . . -69.88 -20.0 75.69 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.926 -0.654 . . . . 0.80000000000000004 112.697 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.411 ' CB ' ' H ' ' A' ' 96' ' ' ASN . 4.7 tpp180 -67.24 -40.61 86.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.404 0.621 . . . . 4.9100000000000001 110.015 179.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.529 HG22 ' CE2' ' A' ' 104' ' ' PHE . 69.8 mt -72.17 -39.39 64.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.407 -0.815 . . . . 1.1100000000000001 110.125 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 97' ' ' TRP . 55.2 t -53.44 -46.99 59.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.837 -0.619 . . . . 2.0299999999999998 110.233 172.278 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -49.31 -51.71 32.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.179 -0.918 . . . . 1.0600000000000001 110.888 174.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -54.63 -44.52 73.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.252 -0.886 . . . . 1.8400000000000001 110.961 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.817 ' HA ' ' HE1' ' A' ' 130' ' ' MET . 57.3 m-85 -64.77 -43.27 93.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.646 0.26 . . . . 4.21 111.146 176.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.512 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 27.3 m -60.9 -49.97 75.31 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.181 -0.463 . . . . 1.55 110.864 -177.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.52 ' CZ ' ' HE2' ' A' ' 57' ' ' PHE . 33.0 m-85 -72.23 -33.63 67.7 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.399 -0.364 . . . . 3.6400000000000001 110.875 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.689 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -69.07 -41.63 80.37 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.569 -0.825 . . . . 0.32000000000000001 111.879 177.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.824 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.46 -37.55 90.12 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.75 -0.738 . . . . 0.23999999999999999 111.483 176.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.21 -28.54 64.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.768 0.318 . . . . 1.05 110.482 176.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.584 ' HB3' HD11 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -64.02 -43.17 96.42 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 108.209 -1.034 . . . . 1.78 108.209 179.286 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.619 ' SG ' HG13 ' A' ' 123' ' ' VAL . 19.5 t -53.27 -55.03 27.85 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 113.861 -1.518 . . . . 0.90000000000000002 110.534 173.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.462 HG13 ' HG3' ' A' ' 20' ' ' LYS . 71.8 t -63.36 -41.28 92.16 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-N 116.127 -0.488 . . . . 1.2 111.624 -178.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.725 ' HB3' HG22 ' A' ' 74' ' ' ILE . 37.2 mm-40 -63.7 -21.95 66.66 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.052 0.453 . . . . 2.5099999999999998 111.254 178.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.533 ' HA ' ' HE1' ' A' ' 119' ' ' MET . 36.9 m -76.2 -40.86 51.24 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.618 -0.882 . . . . 0.28000000000000003 108.618 172.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.585 HG21 ' O ' ' A' ' 111' ' ' CYS . 81.0 t -66.62 -37.37 79.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.967 0.889 . . . . 1.8300000000000001 109.628 -178.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -52.41 -50.21 62.96 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 113.38 -1.736 . . . . 0.59999999999999998 111.37 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.498 ' HE2' ' O ' ' A' ' 113' ' ' GLU . 11.2 mmtt -90.73 14.96 12.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.491 . . . . 2.1600000000000001 110.525 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 63.55 53.12 2.14 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.81 0.814 . . . . 1.8799999999999999 111.075 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.533 ' HE1' ' HA ' ' A' ' 114' ' ' SER . 25.5 mtm -130.1 44.27 2.99 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.804 -1.089 . . . . 1.0800000000000001 108.073 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.464 ' HG2' HG11 ' A' ' 115' ' ' VAL . 4.5 mt-30 -60.92 -7.57 2.51 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.786 -1.097 . . . . 1.1499999999999999 113.068 -174.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.578 HG22 HD23 ' A' ' 122' ' ' LEU . 35.0 m -65.43 -26.04 38.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 122.225 -0.297 . . . . 1.1899999999999999 111.089 175.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.756 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -72.51 -27.75 62.45 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.463 -0.335 . . . . 1.0600000000000001 110.536 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.619 HG13 ' SG ' ' A' ' 111' ' ' CYS . 68.0 t -43.65 -53.03 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 O-C-N 123.968 0.793 . . . . 1.0 111.936 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.562 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 10.3 t -72.14 -40.46 68.04 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.748 0.309 . . . . 1.6599999999999999 110.932 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.756 ' HD2' HD13 ' A' ' 122' ' ' LEU . 92.0 mtt180 -59.98 -53.86 52.85 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 116.158 -0.474 . . . . 3.2999999999999998 110.589 -176.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.63 ' HA ' ' CZ2' ' A' ' 129' ' ' TRP . 87.2 mt -52.41 -48.4 45.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.361 -0.836 . . . . 1.0600000000000001 110.99 -178.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.549 ' HB2' HD21 ' A' ' 13' ' ' LEU . . . -60.14 -27.46 67.1 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.147 0.425 . . . . 1.1000000000000001 112.147 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.78 -61.41 2.08 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 121.486 0.66 . . . . 1.1200000000000001 110.358 -177.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.63 ' CZ2' ' HA ' ' A' ' 126' ' ' ILE . 27.3 p-90 -80.03 -18.07 51.13 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.169 -0.923 . . . . 4.7699999999999996 111.799 -176.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.817 ' HE1' ' HA ' ' A' ' 104' ' ' PHE . 12.4 mmm -58.12 -54.1 50.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.396 0.617 . . . . 1.0900000000000001 109.446 168.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.546 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -64.63 -41.52 96.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.586 -0.734 . . . . 1.05 110.888 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.499 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 70.1 m -57.9 -50.32 73.73 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.98 0.363 . . . . 1.1299999999999999 111.98 176.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.531 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 4.4 m-85 -59.34 -34.77 72.76 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.263 -0.175 . . . . 3.3500000000000001 111.194 -178.211 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.64 HD11 ' HB3' ' A' ' 5' ' ' ASN . 4.2 tt -62.02 -55.99 23.63 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.218 -1.03 . . . . 1.5900000000000001 108.218 170.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . 0.587 ' OD1' ' HB3' ' A' ' 2' ' ' SER . 6.0 m-80 -47.08 -51.3 18.01 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.114 -0.948 . . . . 0.46000000000000002 112.606 -178.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -84.76 -45.78 12.05 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.203 0.446 . . . . 0.58999999999999997 112.203 -173.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . 0.531 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 18.3 m-70 -91.02 -49.92 6.14 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.734 0.642 . . . . 2.3399999999999999 112.734 -171.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 46.7 mt -91.06 -36.75 13.85 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.784 0.661 . . . . 1.8999999999999999 112.784 -165.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.64 ' HA ' HD11 ' A' ' 142' ' ' ILE . 31.5 tt0 -49.77 -50.73 65.7 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 123.54 0.525 . . . . 0.75 112.25 -173.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.576 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 35.2 Cg_exo -57.19 -49.84 12.9 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 121.61 1.54 . . . . 0.87 111.494 176.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . 0.423 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 4.0 t-105 -57.74 -49.26 77.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.489 -0.778 . . . . 1.4299999999999999 110.477 -178.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.64 HD11 ' HA ' ' A' ' 139' ' ' GLU . 47.0 mt -45.27 -53.32 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 122.953 0.501 . . . . 1.1299999999999999 111.655 173.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.622 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.7 mm-40 -59.4 -32.35 70.08 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.91 -0.586 . . . . 0.57999999999999996 111.513 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.567 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.2 mm-40 -66.42 -19.38 65.78 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.248 0.547 . . . . 0.78000000000000003 110.909 178.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -109.75 2.5 20.11 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.478 -0.783 . . . . 0.93000000000000005 110.725 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 126.87 -48.32 0.97 Allowed Glycine 0 N--CA 1.442 -0.961 0 CA-C-N 115.669 -0.696 . . . . 0.56000000000000005 113.075 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 126.08 172.67 13.41 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.852 -0.69 . . . . 0.48999999999999999 111.45 -177.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.655 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 67.1 m95 -65.02 -36.42 84.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.901 0.351 . . . . 4.5199999999999996 111.611 -176.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.576 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 6.0 p-10 -59.95 -33.03 71.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.836 0.35 . . . . 1.96 110.634 177.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.518 ' O ' HD12 ' A' ' 154' ' ' LEU . 89.4 m -68.04 -39.99 82.93 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.047 -0.524 . . . . 1.24 110.935 178.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.573 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 85.9 t80 -61.53 -33.03 73.13 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.942 -0.762 . . . . 3.7200000000000002 108.942 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.576 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 99.0 t -63.08 -55.71 21.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-N 114.569 -1.196 . . . . 1.8600000000000001 110.786 174.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 9.5 mm-40 -47.76 -46.73 30.46 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.469 -0.787 . . . . 1.6699999999999999 111.538 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 150' ' ' THR . 8.4 mp -75.68 -61.18 2.01 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.233 0.827 . . . . 1.96 113.233 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -120.79 21.18 11.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.487 -0.324 . . . . 4.3899999999999997 111.822 -166.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.703 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -67.25 179.08 15.6 Favored Glycine 0 N--CA 1.45 -0.422 0 N-CA-C 115.729 1.051 . . . . 1.1000000000000001 115.729 -172.169 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -73.04 109.49 6.61 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 113.208 -1.496 . . . . 1.29 110.683 -177.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.885 ' HA ' ' HB1' ' A' ' 161' ' ' ALA . 4.0 m-20 -81.1 -7.77 59.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.613 0.598 . . . . 3.4399999999999999 112.613 -173.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.89 -36.21 76.48 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.303 -0.628 . . . . 2.6699999999999999 109.303 171.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -100.21 -36.74 9.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.563 -0.744 . . . . 2.8700000000000001 110.751 174.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 0.885 ' HB1' ' HA ' ' A' ' 158' ' ' ASN . . . -55.11 -51.31 66.82 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.167 -0.47 . . . . 3.2000000000000002 111.862 -178.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.483 ' HG3' ' HB3' ' A' ' 158' ' ' ASN . 44.3 mt-10 -72.65 -27.47 62.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.783 0.325 . . . . 3.7200000000000002 110.842 -176.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 53.4 m -65.53 -30.54 71.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.14 0.495 . . . . 4.2000000000000002 110.266 175.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -91.48 -11.54 37.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.248 0.547 . . . . 6.3700000000000001 111.259 175.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -84.28 -25.98 28.94 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.751 -0.658 . . . . 5.0099999999999998 110.988 -175.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -55.26 -45.13 83.95 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 121.155 -0.545 . . . . 5.0999999999999996 113.359 -174.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -80.12 -23.68 41.02 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 122.417 -0.461 . . . . 5.9400000000000004 111.135 -179.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -81.44 -5.4 57.87 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.677 0.751 . . . . 5.8799999999999999 109.17 178.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.577 ' HD2' ' O ' ' A' ' 169' ' ' ARG . 5.0 tmm_? -89.77 -29.05 18.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.085 -0.961 . . . . 7.7999999999999998 108.81 177.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -84.08 -30.28 26.13 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.519 -0.764 . . . . 7.29 109.997 179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 73.12 144.88 0.07 Allowed 'General case' 0 C--O 1.234 0.255 0 O-C-N 124.415 1.072 . . . . 6.9699999999999998 112.065 172.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -83.17 125.25 31.33 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.179 -0.674 . . . . 9.8100000000000005 109.179 174.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -111.36 162.02 15.47 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.033 0.444 . . . . 11.99 111.484 -173.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 48.2 m80 -73.4 140.91 46.9 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.498 -0.774 . . . . 11.949999999999999 110.69 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -84.96 -24.75 28.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.948 -0.569 . . . . 14.949999999999999 109.511 175.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 74.5 m80 -124.89 109.73 13.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.726 -0.67 . . . . 15.880000000000001 109.494 176.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -138.28 -31.49 0.75 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.277 -0.42 . . . . 16.02 110.914 -175.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 98.8 mt 67.5 2.47 2.94 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.023 0.529 . . . . 18.210000000000001 111.5 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 59.85 -88.86 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 123.423 0.689 . . . . 19.219999999999999 111.982 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . 0.437 ' HB3' ' HB3' ' A' ' 183' ' ' HIS . 97.4 m-70 -123.03 141.15 52.27 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.731 -0.47 . . . . 22.800000000000001 109.731 -178.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -86.79 -41.77 13.82 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.371 -0.377 . . . . 22.510000000000002 110.809 -177.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 10.1 p80 -150.42 21.46 0.83 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.238 0.542 . . . . 25.300000000000001 110.291 178.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . 0.437 ' HB3' ' HB3' ' A' ' 180' ' ' HIS . 18.3 t60 -101.96 115.56 30.8 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.799 -0.637 . . . . 25.77 109.869 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -140.93 129.9 23.2 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.098 -0.501 . . . . 27.370000000000001 109.812 178.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 86.0 t60 . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.387 -0.816 . . . . 29.52 110.252 -179.454 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.237 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . 78.21 -71.72 2.41 Favored Glycine 0 N--CA 1.45 -0.433 0 O-C-N 121.7 -0.625 . . . . 2.9900000000000002 112.36 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1003 ' ' CYS . . . . . . . . . . . . . 9.8 m -119.36 -155.9 0.63 Allowed 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.8 -0.444 . . . . 1.9399999999999999 109.8 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.919 HG23 ' H ' ' B' 1005 ' ' GLY . 33.1 m 46.9 -84.68 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 O-C-N 124.547 1.154 . . . . 1.9399999999999999 112.92 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 0.919 ' H ' HG23 ' B' 1004 ' ' VAL . . . -37.15 -38.36 0.35 Allowed Glycine 0 CA--C 1.533 1.195 0 CA-C-N 119.219 0.918 . . . . 1.26 112.774 161.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B 1006 ' ' ARG . . . . . 0.529 ' HA ' ' CZ ' ' B' 1006 ' ' ARG . 1.6 tpm_? -56.32 -52.3 65.07 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.707 0.765 . . . . 3.4500000000000002 111.669 172.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B 1007 ' ' ALA . . . . . 0.787 ' HB2' ' H7 ' ' B' 1100 ' ' 33B . . . -99.67 -153.5 0.44 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.571 -1.195 . . . . 1.54 110.063 -172.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 1.019 ' HG ' HG12 ' A' ' 86' ' ' VAL . 2.8 mm? 64.43 -74.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 O-C-N 123.963 0.789 . . . . 1.8999999999999999 111.384 174.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 1.004 ' HB2' ' HB3' ' A' ' 89' ' ' GLU . . . -46.06 -64.3 0.78 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.632 0.73 . . . . 1.45 110.574 169.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.41 ' O ' ' HB3' ' B' 1013 ' ' ASP . . . -52.5 -40.06 61.97 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 114.597 -1.183 . . . . 1.51 112.43 -178.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.495 ' CG ' ' C13' ' B' 1100 ' ' 33B . 80.6 m-85 -98.75 7.02 46.55 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.188 -0.46 . . . . 2.0699999999999998 111.297 -172.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.79 -16.89 79.16 Favored Glycine 0 CA--C 1.501 -0.787 0 N-CA-C 108.726 -1.75 . . . . 0.80000000000000004 108.726 166.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1013 ' ' ASP . . . . . 0.41 ' HB3' ' O ' ' B' 1010 ' ' ALA . 17.4 t70 -72.78 -2.88 22.19 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.36 -1.42 . . . . 1.8999999999999999 110.863 171.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B 1014 ' ' CYS . . . . . 0.694 ' SG ' ' HB3' ' A' ' 60' ' ' ARG . 15.3 t -59.39 -37.38 77.84 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 121.334 0.588 . . . . 1.4399999999999999 110.057 178.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.461 HG22 ' HA3' ' A' ' 98' ' ' GLY . 14.6 tt -115.46 47.49 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-O 122.437 1.113 . . . . 3.4300000000000002 109.531 -178.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 50.2 t-20 -75.47 -55.4 5.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.837 -1.074 . . . . 4.79 109.774 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -147.45 -74.51 0.2 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.948 -0.569 . . . . 8.9800000000000004 110.397 -177.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.586 0 CA-C-N 116.593 -0.276 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.787 ' H7 ' ' HB2' ' B' 1007 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.9 mtt . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 109.959 -0.385 . . . . 6.4500000000000002 109.959 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.8 p -137.19 -48.19 0.59 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.827 0.346 . . . . 2.2599999999999998 110.906 178.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.455 ' O ' ' HB2' ' A' ' 37' ' ' ALA . 20.7 mp0 -79.8 1.43 26.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.865 0.364 . . . . 2.7599999999999998 111.257 -178.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -20.67 66.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.3 -0.409 . . . . 1.54 111.461 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.934 ' HA ' HD22 ' A' ' 8' ' ' LEU . 70.1 m-20 -64.65 -22.35 66.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.21 -0.45 . . . . 1.78 110.477 178.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.802 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.2 tpp180 -54.81 -52.95 61.09 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.814 -0.63 . . . . 1.8999999999999999 110.449 176.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.758 ' HB3' ' HE3' ' A' ' 47' ' ' LYS . 46.9 mt-10 -57.94 -46.39 85.13 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.274 -0.876 . . . . 0.68000000000000005 110.905 -177.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.934 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.2 OUTLIER -52.77 -32.49 43.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.078 -0.965 . . . . 1.8 111.217 179.304 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.487 HG23 ' N ' ' A' ' 131' ' ' ALA . 67.7 t -80.24 -61.1 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.308 0.575 . . . . 1.0700000000000001 109.8 174.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.521 HG11 ' CE2' ' A' ' 24' ' ' TRP . 95.2 t -50.1 -54.77 7.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.815 -1.084 . . . . 1.1299999999999999 112.506 -175.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -49.24 -43.28 42.59 Favored 'General case' 0 CA--C 1.52 -0.205 0 O-C-N 123.472 0.482 . . . . 0.58999999999999997 110.57 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.616 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 1.6 t80 -72.43 -42.44 65.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.879 -0.6 . . . . 2.02 111.077 -175.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.959 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.2 mp -62.75 -40.39 97.11 Favored 'General case' 0 C--O 1.231 0.124 0 C-N-CA 120.277 -0.569 . . . . 1.0600000000000001 110.185 177.027 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.7 m -62.57 -39.11 92.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.553 0.692 . . . . 1.6000000000000001 109.929 176.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -63.81 -18.7 64.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.739 -1.118 . . . . 1.49 111.024 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.66 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.7 mmpt? -90.57 -52.77 4.73 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.31 0.576 . . . . 1.8400000000000001 110.054 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.598 HD22 HG21 ' A' ' 112' ' ' VAL . 13.6 mt -55.36 -31.41 61.73 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.687 -1.142 . . . . 1.98 111.419 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.8 t -60.41 -31.1 70.07 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.962 -0.563 . . . . 1.3799999999999999 111.621 177.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -75.68 -21.42 57.64 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-O 121.792 0.806 . . . . 1.51 110.448 -178.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.52 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 9.8 mmmt -96.45 -26.58 15.26 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.224 -1.353 . . . . 2.6499999999999999 108.665 -174.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.03 19.4 17.08 Favored Glycine 0 N--CA 1.437 -1.295 0 CA-C-N 113.744 -1.571 . . . . 0.54000000000000004 111.976 176.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.52 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 31.8 m-85 -99.63 154.9 17.91 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.753 0.311 . . . . 1.1200000000000001 110.343 177.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.0 t -92.29 142.81 27.05 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.998 -0.546 . . . . 0.75 109.572 175.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.642 ' HZ2' HG21 ' A' ' 30' ' ' VAL . 27.9 t-105 -74.5 -49.44 22.13 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.622 -0.51 . . . . 4.29 109.622 176.079 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.8 m -58.94 -35.89 73.86 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.771 -0.65 . . . . 1.8600000000000001 111.725 -176.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -61.64 -25.78 67.58 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.894 0.378 . . . . 1.52 111.965 -178.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -120.24 19.15 12.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.358 -0.383 . . . . 1.53 110.933 -178.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.443 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 37.4 p -100.26 -178.85 3.95 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.625 0.726 . . . . 2.04 112.097 -172.153 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.53 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 5.4 t70 -161.52 -23.9 0.05 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.403 -1.271 . . . . 2.3100000000000001 108.899 -178.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.675 HG22 ' H ' ' A' ' 31' ' ' GLU . 3.4 m -53.91 -72.43 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 114.269 -1.332 . . . . 1.4099999999999999 112.827 -175.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.675 ' H ' HG22 ' A' ' 30' ' ' VAL . 32.4 mt-10 -89.69 -4.26 57.82 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.632 -0.877 . . . . 2.7400000000000002 108.632 178.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.53 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 23.2 tt0 -72.26 -52.32 16.87 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 114.45 -1.25 . . . . 1.45 111.222 -175.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -97.29 -34.24 11.15 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.978 0.362 . . . . 1.8700000000000001 111.978 -174.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -123.61 159.1 29.98 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.768 -0.373 . . . . 3.8199999999999998 110.393 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 16.7 p -120.69 103.67 9.3 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.467 0.651 . . . . 2.6699999999999999 110.572 176.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.962 ' HG3' ' H ' ' A' ' 37' ' ' ALA . 10.3 pt-20 -101.06 -88.37 0.37 Allowed 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.363 -0.835 . . . . 3.3399999999999999 111.329 -179.05 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.962 ' H ' ' HG3' ' A' ' 36' ' ' GLU . . . -70.16 148.24 95.82 Favored Pre-proline 0 C--N 1.309 -1.169 0 CA-C-N 115.241 -0.891 . . . . 2.4399999999999999 111.503 178.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.802 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 76.3 Cg_exo -55.53 -173.27 0.03 OUTLIER 'Trans proline' 0 CA--C 1.535 0.542 0 C-N-CA 123.519 2.812 . . . . 1.8700000000000001 112.487 169.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -87.83 15.24 7.31 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.338 0.59 . . . . 4.6399999999999997 110.322 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 141.29 62.42 0.03 OUTLIER Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 115.594 -0.73 . . . . 2.3999999999999999 111.739 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.802 ' HB ' ' HG2' ' A' ' 38' ' ' PRO . 1.2 t -68.8 -75.02 0.11 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 120.854 -0.338 . . . . 1.45 110.547 -177.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.798 ' H ' HG23 ' A' ' 41' ' ' THR . 14.2 pt-20 -92.88 -30.95 15.15 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 122.27 1.033 . . . . 2.02 108.315 168.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.57 -35.57 68.33 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 112.742 -2.027 . . . . 1.25 113.425 -170.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -45.17 -53.48 8.09 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 123.967 0.792 . . . . 1.9099999999999999 111.721 -173.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.419 ' HB2' HG23 ' A' ' 152' ' ' VAL . . . -72.39 -38.96 68.34 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.794 0.294 . . . . 1.1799999999999999 111.794 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.66 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 1.4 m -71.47 -41.71 72.92 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 120.939 -0.305 . . . . 2.0099999999999998 111.016 -175.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.758 ' HE3' ' HB3' ' A' ' 7' ' ' GLU . 0.4 OUTLIER -71.77 -30.24 65.35 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.298 -0.63 . . . . 1.3799999999999999 109.298 178.742 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.495 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 3.1 mm100 -64.61 -35.68 81.79 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.98999999999999999 110.266 172.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.584 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -75.65 -34.23 60.5 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.114 -0.493 . . . . 1.1399999999999999 110.597 176.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.66 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 12.5 mt -64.02 -28.0 69.5 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 115.514 -0.767 . . . . 1.95 112.364 -176.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 7.9 ptm180 -81.07 -30.72 34.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.861 0.839 . . . . 2.5099999999999998 108.998 -176.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -74.99 -49.93 18.28 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.172 -1.376 . . . . 1.1000000000000001 109.786 -178.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.45 -34.12 77.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.724 -0.671 . . . . 1.04 109.87 175.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.748 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -58.7 -57.33 20.42 Favored Glycine 0 N--CA 1.442 -0.911 0 CA-C-N 115.262 -0.881 . . . . 0.69999999999999996 111.758 177.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -55.12 -43.16 73.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.807 0.337 . . . . 1.04 111.265 -177.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.43 ' CD ' HH21 ' B' 1017 ' ' ARG . 27.3 mm-40 -59.5 -34.25 72.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.771 -0.65 . . . . 2.29 111.479 177.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.613 ' CE1' ' HA2' ' B' 1012 ' ' GLY . 67.0 t80 -81.6 -40.48 22.93 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.912 -0.585 . . . . 2.9300000000000002 111.323 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.748 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 56.9 mt-10 -62.92 -42.19 99.72 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.314 -0.403 . . . . 1.3 111.745 -173.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.1 pp -59.73 -19.09 47.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.22 -0.446 . . . . 2.1899999999999999 111.526 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 32.8 mtp-105 -79.7 -53.67 6.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.087 -0.506 . . . . 3.1400000000000001 110.953 -179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.636 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 15.3 p90 -92.18 -5.72 52.04 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.672 0.619 . . . . 5.5899999999999999 112.672 -172.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.789 ' HG3' ' HE1' ' A' ' 65' ' ' PHE . 50.8 ttt180 -50.99 -38.49 51.45 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.28 0.474 . . . . 4.9299999999999997 112.28 -170.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -52.85 -38.14 61.11 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.051 0.389 . . . . 5.3499999999999996 112.051 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.433 ' O ' HD12 ' A' ' 68' ' ' LEU . . . -82.78 -48.82 10.39 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 112.906 0.706 . . . . 1.7 112.906 -172.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.789 ' HE1' ' HG3' ' A' ' 62' ' ' ARG . 5.1 p90 -60.04 -26.99 66.55 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.49 0.552 . . . . 3.52 112.49 -166.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.1 t -68.02 -32.71 73.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.154 0.502 . . . . 2.5899999999999999 110.106 177.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -90.13 -25.82 20.5 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.583 0.706 . . . . 2.7200000000000002 110.397 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.709 ' O ' HD13 ' A' ' 72' ' ' LEU . 2.0 mp -75.31 -18.02 60.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.292 -0.867 . . . . 2.25 112.424 -176.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.731 HG23 HG13 ' A' ' 74' ' ' ILE . 1.2 p -57.3 -34.42 68.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 118.147 0.431 . . . . 1.26 111.043 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 45.6 t -63.88 -41.7 97.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.385 0.612 . . . . 1.8 109.924 173.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.659 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 9.0 mt-30 -66.77 -39.12 87.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.113 -0.949 . . . . 1.8899999999999999 110.652 -178.196 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.709 HD13 ' O ' ' A' ' 68' ' ' LEU . 1.1 mt -76.2 -30.15 57.89 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.552 -0.749 . . . . 1.98 110.408 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 68.55 50.72 0.67 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.447 0.642 . . . . 3.54 109.616 -176.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.731 HG13 HG23 ' A' ' 69' ' ' THR . 25.5 mm -55.47 114.93 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.609 -1.178 . . . . 1.1499999999999999 111.419 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.764 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.95 -170.24 0.24 Allowed Pre-proline 0 CA--C 1.549 0.923 0 N-CA-C 107.514 -1.291 . . . . 1.1200000000000001 107.514 -171.566 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.764 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 32.2 Cg_exo -29.33 167.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.128 0 C-N-CA 125.218 3.945 . . . . 0.53000000000000003 115.326 162.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -28.56 -27.46 0.0 OUTLIER Glycine 0 N--CA 1.475 1.239 0 N-CA-C 117.828 1.891 . . . . 0.40999999999999998 117.828 -173.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.469 ' N ' ' O ' ' A' ' 76' ' ' PRO . 40.7 p -65.67 1.93 1.13 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 118.946 1.373 . . . . 1.22 112.0 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.26 -12.16 60.76 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.551 -0.295 . . . . 1.0700000000000001 110.262 174.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.451 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 2.8 m-85 -73.62 -22.85 59.88 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.644 -0.872 . . . . 4.3099999999999996 108.644 174.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -81.95 -26.15 34.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.392 -0.822 . . . . 1.03 109.725 176.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.626 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 3.2 m -73.54 -51.51 16.72 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.63 -1.168 . . . . 0.47999999999999998 109.05 172.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.79 ' HA ' HG21 ' A' ' 86' ' ' VAL . 69.3 t80 -67.66 -17.89 64.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.115 -0.948 . . . . 1.4399999999999999 110.276 176.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.565 ' HA ' HG11 ' A' ' 87' ' ' VAL . 42.5 tt0 -61.64 -50.56 72.05 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.925 -0.579 . . . . 0.80000000000000004 110.409 177.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -47.23 -33.33 5.31 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 114.856 -1.066 . . . . 1.99 110.311 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.827 HG12 HD13 ' B' 1008 ' ' LEU . 1.3 t -85.91 -55.13 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.981 0 CA-C-N 114.01 -1.45 . . . . 1.8999999999999999 110.912 -174.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.565 HG11 ' HA ' ' A' ' 84' ' ' GLU . 4.9 p -62.86 -17.95 20.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-O 122.098 0.951 . . . . 1.4299999999999999 109.959 -176.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.564 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 4.5 m-80 -86.02 -35.58 20.26 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.148 -1.387 . . . . 0.91000000000000003 112.057 176.073 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 1.012 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.2 pp20? -74.65 -35.58 62.85 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 122.107 0.956 . . . . 2.8700000000000001 108.518 177.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.633 HD11 ' OE2' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -67.13 -33.36 75.28 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 113.569 -1.651 . . . . 1.9199999999999999 110.879 -167.921 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.658 ' HA ' HG23 ' A' ' 95' ' ' VAL . 2.9 p90 -98.53 -16.62 19.09 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.774 -0.37 . . . . 2.9700000000000002 111.097 -174.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.623 ' CD ' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -88.81 -30.15 19.19 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.35 -0.54 . . . . 5.6699999999999999 111.139 -177.179 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -92.24 2.63 56.5 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.662 0.616 . . . . 3.1200000000000001 112.662 -168.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 131.67 71.78 0.1 OUTLIER Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 117.339 -2.362 . . . . 2.3100000000000001 114.954 -174.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.658 HG23 ' HA ' ' A' ' 91' ' ' PHE . 49.1 t -70.14 98.52 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 118.144 0.972 . . . . 1.6799999999999999 110.492 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.615 HD21 ' N ' ' A' ' 96' ' ' ASN . 0.7 OUTLIER -108.93 -179.06 3.75 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.311 -1.313 . . . . 2.1200000000000001 108.902 178.1 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.799 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 19.3 m-90 -51.37 -52.9 41.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.224 0.535 . . . . 4.1200000000000001 111.015 176.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.794 ' HA3' HG22 ' B' 1015 ' ' ILE . . . -81.36 -14.18 79.12 Favored Glycine 0 CA--C 1.519 0.324 0 CA-C-N 115.759 -0.655 . . . . 0.80000000000000004 113.637 -175.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.573 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 9.4 tpp180 -63.21 -42.4 99.28 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.291 0.567 . . . . 4.9100000000000001 110.496 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.565 HG23 ' CE2' ' A' ' 104' ' ' PHE . 89.8 mt -72.89 -33.61 44.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.671 . . . . 1.1100000000000001 110.438 -179.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.522 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 72.8 t -49.1 -54.45 5.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.764 -0.653 . . . . 2.0299999999999998 109.804 168.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.49 -47.22 66.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.886 -1.052 . . . . 1.0600000000000001 111.126 175.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -55.56 -39.67 70.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.579 -0.737 . . . . 1.8400000000000001 111.395 178.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.565 ' CE2' HG23 ' A' ' 100' ' ' ILE . 30.7 m-85 -69.92 -33.74 72.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.632 0.253 . . . . 4.21 110.88 175.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.616 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 18.1 t -68.58 -53.84 20.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.484 -0.325 . . . . 1.55 110.674 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.549 ' CZ ' ' HB3' ' B' 1008 ' ' LEU . 35.4 m-85 -63.98 -38.63 91.78 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-O 120.552 0.215 . . . . 3.6400000000000001 110.581 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -69.82 -39.18 76.32 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.619 -0.801 . . . . 0.32000000000000001 111.792 177.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.959 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.04 -36.19 91.63 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 111.303 -0.719 . . . . 0.23999999999999999 111.303 176.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -73.59 -29.14 62.21 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.229 -0.285 . . . . 1.05 110.229 175.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.46 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -61.3 -40.68 95.07 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 107.723 -1.214 . . . . 1.78 107.723 178.155 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.72 ' HG ' HG12 ' A' ' 123' ' ' VAL . 39.9 t -51.57 -63.73 1.04 Allowed 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 113.612 -1.631 . . . . 0.90000000000000002 110.174 172.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.768 ' HA ' HG11 ' A' ' 115' ' ' VAL . 43.6 t -64.15 -37.89 81.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.202 0.445 . . . . 1.2 112.202 -174.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.576 ' HB3' HG21 ' A' ' 74' ' ' ILE . 13.6 mm-40 -59.52 -16.95 27.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.185 0.517 . . . . 2.5099999999999998 110.767 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.595 ' HA ' ' HE2' ' A' ' 119' ' ' MET . 63.9 m -85.1 -46.86 10.74 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 107.997 -1.112 . . . . 0.28000000000000003 107.997 176.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.768 HG11 ' HA ' ' A' ' 112' ' ' VAL . 1.7 m -66.38 -34.22 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-N 114.783 -1.099 . . . . 1.8300000000000001 109.897 -174.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -50.32 -51.31 46.45 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 113.066 -1.879 . . . . 0.59999999999999998 111.153 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.421 ' CG ' ' HE3' ' A' ' 119' ' ' MET . 24.1 mmtt -86.0 15.5 4.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.796 -0.638 . . . . 2.1600000000000001 110.109 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.483 ' HA ' ' NE2' ' A' ' 120' ' ' GLN . 39.0 mt-10 65.89 49.29 1.67 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 122.037 0.922 . . . . 1.8799999999999999 110.176 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.595 ' HE2' ' HA ' ' A' ' 114' ' ' SER . 27.9 mtm -129.59 37.12 4.02 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.329 -1.305 . . . . 1.0800000000000001 107.889 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.725 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 1.9 mp0 -54.51 -8.05 0.2 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.921 -1.036 . . . . 1.1499999999999999 112.684 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.608 HG23 HD22 ' A' ' 122' ' ' LEU . 27.3 m -68.25 -22.5 27.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 O-C-N 122.102 -0.374 . . . . 1.1899999999999999 111.868 176.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.622 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.6 mm? -75.26 -24.89 57.66 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 120.956 0.408 . . . . 1.0600000000000001 110.137 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.72 HG12 ' HG ' ' A' ' 111' ' ' CYS . 46.7 t -45.19 -52.55 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 114.857 -1.065 . . . . 1.0 112.346 -176.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.443 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 0.1 OUTLIER -75.46 -33.59 60.86 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 121.044 0.449 . . . . 1.6599999999999999 111.196 -178.468 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.622 ' HD2' HD13 ' A' ' 122' ' ' LEU . 74.0 mtt180 -65.97 -52.5 49.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.67 -0.695 . . . . 3.2999999999999998 110.738 -176.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.557 HG22 ' SD ' ' A' ' 130' ' ' MET . 69.5 mt -53.6 -49.97 52.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.769 -0.651 . . . . 1.0600000000000001 111.331 179.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.672 ' HB3' HD23 ' A' ' 13' ' ' LEU . . . -58.17 -32.53 68.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.624 -0.262 . . . . 1.1000000000000001 111.58 -177.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.802 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -58.75 -61.68 2.44 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.198 0.523 . . . . 1.1200000000000001 110.353 176.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -62.11 -35.67 79.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.86 -1.064 . . . . 4.7699999999999996 111.2 -176.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.557 ' SD ' HG22 ' A' ' 126' ' ' ILE . 88.2 mtp -60.86 -54.59 43.18 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.779 0.323 . . . . 1.0900000000000001 111.435 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.487 ' N ' HG23 ' A' ' 9' ' ' VAL . . . -62.23 -43.01 99.79 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.26 -0.427 . . . . 1.05 111.004 -178.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 97.2 m -61.4 -44.39 97.23 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.838 -0.345 . . . . 1.1299999999999999 110.695 177.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.45 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 26.6 t80 -56.7 -40.24 75.27 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.153 -0.314 . . . . 3.3500000000000001 110.153 178.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.899 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 3.8 tt -61.42 -54.88 37.8 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.78 -0.822 . . . . 1.5900000000000001 108.78 174.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -51.75 -44.02 63.16 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.181 -0.918 . . . . 0.46000000000000002 112.426 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -84.68 -52.69 5.9 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.215 0.531 . . . . 0.58999999999999997 111.906 -175.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . 0.45 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 7.2 m80 -91.4 -51.77 5.12 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 113.124 0.787 . . . . 2.3399999999999999 113.124 -171.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.899 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -80.74 -45.6 16.8 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.007 1.114 . . . . 1.8999999999999999 114.007 -165.081 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.706 ' HA ' HD12 ' A' ' 142' ' ' ILE . 27.6 tt0 -44.99 -50.29 26.74 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 112.689 0.626 . . . . 0.75 112.689 -174.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.546 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 51.3 Cg_exo -54.38 -50.87 12.0 Favored 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 121.856 1.704 . . . . 0.87 111.861 176.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 -58.02 -49.5 76.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.529 -0.759 . . . . 1.4299999999999999 110.31 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.706 HD12 ' HA ' ' A' ' 139' ' ' GLU . 61.8 mt -46.58 -53.91 2.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.921 -0.581 . . . . 1.1299999999999999 111.683 175.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.552 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 72.3 mm-40 -60.14 -30.72 69.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.846 -0.616 . . . . 0.57999999999999996 111.739 -178.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.546 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 6.4 mm-40 -68.28 -22.9 64.71 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.354 0.597 . . . . 0.78000000000000003 110.746 177.161 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.629 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -99.54 -20.9 16.15 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.421 -0.808 . . . . 0.93000000000000005 110.151 -173.071 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 146.7 -33.57 1.4 Allowed Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.791 -0.719 . . . . 0.56000000000000005 112.686 175.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . 0.538 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 110.1 169.92 19.89 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.565 -0.826 . . . . 0.48999999999999999 111.844 -177.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.566 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 65.2 m95 -68.03 -34.39 76.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.731 0.265 . . . . 4.5199999999999996 111.568 -178.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -58.25 -47.1 84.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.067 0.46 . . . . 1.96 110.243 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.526 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 95.4 m -61.0 -35.37 76.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.606 -0.724 . . . . 1.24 111.178 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.799 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 84.0 t80 -59.54 -40.96 88.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.742 0.306 . . . . 3.7200000000000002 110.672 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.594 HG11 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -73.8 -24.94 20.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.322 0.582 . . . . 1.8600000000000001 110.089 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.78 -22.45 66.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.066 0.46 . . . . 1.6699999999999999 109.948 173.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 150' ' ' THR . 5.0 mt -94.33 -58.34 2.24 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.916 -0.584 . . . . 1.96 110.779 177.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -121.25 27.74 8.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.976 -0.556 . . . . 4.3899999999999997 111.591 -173.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.584 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -65.7 163.43 40.24 Favored Glycine 0 CA--C 1.497 -1.083 0 C-N-CA 120.865 -0.683 . . . . 1.1000000000000001 113.056 -178.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.495 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 24.9 t-20 -63.64 108.68 1.46 Allowed 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 114.205 -0.998 . . . . 1.29 110.68 178.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.732 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 6.0 m120 -82.0 -24.04 35.65 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.322 -0.399 . . . . 3.4399999999999999 111.414 -177.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -53.97 -45.13 71.26 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-O 120.773 0.321 . . . . 2.6699999999999999 111.109 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -82.37 -35.55 27.67 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.237 -0.438 . . . . 2.8700000000000001 110.556 177.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 0.492 ' HB1' ' HA ' ' A' ' 158' ' ' ASN . . . -55.12 -60.83 2.84 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.844 -0.616 . . . . 3.2000000000000002 111.284 -179.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.732 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 10.4 pt-20 -65.92 -29.15 69.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.65 -0.25 . . . . 3.7200000000000002 111.531 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 37.6 t -64.77 -40.31 95.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.129 0.49 . . . . 4.2000000000000002 110.139 -178.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -90.5 -0.47 57.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.978 -0.555 . . . . 6.3700000000000001 110.379 178.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.533 ' HB3' ' HA ' ' A' ' 162' ' ' GLU . 34.0 ttpt -100.3 -56.15 2.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.549 -0.75 . . . . 5.0099999999999998 111.267 -177.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -65.7 -11.92 55.15 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.585 -0.734 . . . . 5.0999999999999996 113.491 -172.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -68.93 -21.43 64.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.951 0.376 . . . . 5.9400000000000004 110.368 176.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -76.0 -5.91 48.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.982 -0.554 . . . . 5.8799999999999999 110.571 176.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.586 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 1.1 tmt_? -85.74 -28.8 24.36 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.288 -0.634 . . . . 7.7999999999999998 109.288 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -99.87 -63.51 1.12 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.907 -0.588 . . . . 7.29 110.121 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -113.66 -158.7 0.67 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.08 -0.711 . . . . 6.9699999999999998 109.08 176.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 54.5 m80 -139.7 116.06 10.57 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.05 0.452 . . . . 9.8100000000000005 110.833 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 30.9 t60 -83.94 -36.24 23.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.735 -0.666 . . . . 11.99 109.641 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -76.92 -48.44 18.21 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.737 -0.665 . . . . 11.949999999999999 110.242 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 60.3 t60 -84.7 105.97 15.9 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.008 -0.542 . . . . 14.949999999999999 110.465 177.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 35.8 m-70 -84.17 110.99 18.94 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.384 -0.371 . . . . 15.880000000000001 110.197 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -67.69 -38.27 83.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.914 -0.585 . . . . 16.02 111.072 -178.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 39.2 tp 65.19 106.83 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.13 0 O-C-N 123.919 0.762 . . . . 18.210000000000001 110.409 -176.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 46.9 mm-40 -75.05 170.22 16.45 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.284 -0.416 . . . . 19.219999999999999 111.007 -177.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -69.32 121.4 16.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.932 -0.576 . . . . 22.800000000000001 110.851 -177.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 44.2 m80 -72.39 125.64 27.88 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.989 -0.551 . . . . 22.510000000000002 110.91 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -81.58 153.57 26.66 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.891 -0.595 . . . . 25.300000000000001 110.273 177.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 66.65 32.07 7.29 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 123.51 0.506 . . . . 25.77 110.909 -178.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -121.27 75.7 1.18 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.262 -0.426 . . . . 27.370000000000001 110.549 178.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 52.1 m80 . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.205 -0.902 . . . . 29.52 109.906 175.732 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.158 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B 1002 ' ' GLY . . . . . 0.558 ' C ' ' H1 ' ' B' 1100 ' ' 33B . . . -73.47 -40.91 46.47 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.926 -0.654 . . . . 2.9900000000000002 112.592 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.474 ' HB2' HE22 ' A' ' 71' ' ' GLN . 5.1 m -122.9 -150.46 0.45 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 122.458 -0.437 . . . . 1.9399999999999999 110.512 -176.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.856 ' HA ' ' HG ' ' B' 1008 ' ' LEU . 10.8 m 42.27 -92.42 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 O-C-N 124.515 1.135 . . . . 1.9399999999999999 112.992 175.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 0.665 ' H ' HG21 ' B' 1004 ' ' VAL . . . -31.56 -42.57 0.1 OUTLIER Glycine 0 CA--C 1.529 0.937 0 CA-C-N 118.351 0.523 . . . . 1.26 113.708 164.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -94.07 -40.48 10.05 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 111.922 0.341 . . . . 3.4500000000000002 111.922 176.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1007 ' ' ALA . . . . . 0.543 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -78.52 -48.16 15.87 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 113.119 0.785 . . . . 1.54 113.119 -167.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.856 ' HG ' ' HA ' ' B' 1004 ' ' VAL . 7.7 mt -75.22 -37.31 61.17 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.279 -0.637 . . . . 1.8999999999999999 109.279 -171.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 1.012 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -52.86 -49.79 65.09 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.002 -0.999 . . . . 1.45 110.169 169.161 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.829 ' HB1' ' N11' ' B' 1100 ' ' 33B . . . -68.28 -50.18 55.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.283 -1.326 . . . . 1.51 111.966 -176.106 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.613 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 34.1 m-85 -73.14 -23.17 60.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.138 -0.483 . . . . 2.0699999999999998 111.478 -177.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 1012 ' ' GLY . . . . . 0.613 ' HA2' ' CE1' ' A' ' 57' ' ' PHE . . . -74.61 -10.1 82.66 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 121.018 -0.611 . . . . 0.80000000000000004 113.01 -177.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -74.51 -20.96 59.78 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.08 0.467 . . . . 1.8999999999999999 110.898 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -98.03 93.16 6.14 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.447 -0.342 . . . . 1.4399999999999999 110.886 -175.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.794 HG22 ' HA3' ' A' ' 98' ' ' GLY . 19.1 pt -115.19 37.79 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.576 0.703 . . . . 3.4300000000000002 110.61 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 20.8 p30 -155.3 29.87 0.39 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.294 -0.866 . . . . 4.79 109.997 -176.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 1017 ' ' ARG . . . . . 0.43 HH21 ' CD ' ' A' ' 56' ' ' GLU . 17.8 mmt180 61.38 79.88 0.24 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.368 -0.833 . . . . 8.9800000000000004 110.645 -174.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 116.306 -0.407 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.829 ' N11' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.6 ptt? . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 121.665 0.745 . . . . 6.4500000000000002 110.323 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.0 m -87.11 125.25 34.02 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.48 -0.782 . . . . 2.2599999999999998 110.887 -177.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.474 ' O ' ' HB3' ' A' ' 37' ' ' ALA . 72.1 mm-40 -64.03 -25.4 68.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.08 0.467 . . . . 2.7599999999999998 110.13 176.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.11 -17.69 64.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.458 -0.792 . . . . 1.54 112.467 -177.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.66 ' ND2' HD22 ' A' ' 134' ' ' LEU . 21.8 m-20 -67.86 -15.76 63.77 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 120.52 -0.472 . . . . 1.78 110.005 178.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.541 HH12 ' HA ' ' A' ' 128' ' ' ALA . 12.3 tpp180 -56.83 -48.91 76.95 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.921 -0.581 . . . . 1.8999999999999999 109.747 174.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.526 ' OE1' ' HA2' ' A' ' 40' ' ' GLY . 33.9 mt-10 -53.49 -51.81 61.58 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.768 -1.105 . . . . 0.68000000000000005 111.118 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.611 HD21 ' HA ' ' A' ' 5' ' ' ASN . 1.2 mp -49.13 -35.04 15.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.864 -1.062 . . . . 1.8 111.499 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.512 HG22 ' N ' ' A' ' 131' ' ' ALA . 72.4 t -80.63 -59.54 2.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.837 -0.62 . . . . 1.0700000000000001 110.375 175.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.524 HG22 ' O ' ' A' ' 6' ' ' ARG . 85.0 t -51.96 -55.64 8.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.852 -1.067 . . . . 1.1299999999999999 113.059 -176.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -54.97 -30.85 60.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.974 0.416 . . . . 0.58999999999999997 110.493 -176.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.733 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 4.0 t80 -79.18 -51.51 9.41 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.889 -0.596 . . . . 2.02 110.546 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.932 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.0 mp -58.89 -42.95 90.77 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 121.01 -0.276 . . . . 1.0600000000000001 110.899 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.406 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 38.4 t -58.39 -40.43 82.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.283 0.563 . . . . 1.6000000000000001 110.424 178.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -71.56 -23.75 61.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.795 -0.639 . . . . 1.49 110.289 -179.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.608 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.2 mmpt? -85.1 -28.78 25.36 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 116.457 -0.338 . . . . 1.8400000000000001 110.929 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.473 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -72.73 -26.33 61.54 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.066 -0.654 . . . . 1.98 109.396 172.783 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.7 t -65.18 -33.78 76.82 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.58 -0.736 . . . . 1.3799999999999999 111.735 -178.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 16.8 pt20 -76.11 -6.04 49.35 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.367 0.603 . . . . 1.51 111.022 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.539 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.5 mmmt -109.01 -27.78 9.46 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.961 0.886 . . . . 2.6499999999999999 108.854 -178.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.4 23.25 9.69 Favored Glycine 0 N--CA 1.441 -1.009 0 CA-C-N 113.996 -1.457 . . . . 0.54000000000000004 111.438 177.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.509 ' HD2' ' HZ ' ' A' ' 27' ' ' PHE . 84.4 m-85 -110.55 163.58 13.57 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.033 0.444 . . . . 1.1200000000000001 111.003 179.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.8 t -101.42 145.37 29.04 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.821 -0.627 . . . . 0.75 110.176 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.412 ' NE1' HG11 ' A' ' 10' ' ' VAL . 0.5 OUTLIER -69.78 -47.46 62.82 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.044 -0.526 . . . . 4.29 110.713 176.573 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.7 t -75.6 -23.18 56.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.417 -0.356 . . . . 1.8600000000000001 111.599 -170.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -61.39 -25.47 67.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.222 0.534 . . . . 1.52 111.124 176.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.509 ' HZ ' ' HD2' ' A' ' 22' ' ' TYR . 6.6 m-85 -113.09 -22.21 10.66 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.979 -0.555 . . . . 1.53 111.16 -176.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.571 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 19.3 m -101.24 144.87 29.58 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 122.32 1.057 . . . . 2.04 112.163 -178.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -118.18 -5.21 10.92 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.379 -1.737 . . . . 2.3100000000000001 109.512 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.684 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.4 m -53.57 -73.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.135 -1.393 . . . . 1.4099999999999999 113.257 -165.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.684 ' H ' HG23 ' A' ' 30' ' ' VAL . 10.4 pt-20 -96.97 2.12 51.15 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.122 -0.696 . . . . 2.7400000000000002 109.122 177.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -71.29 -57.68 4.24 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.761 -1.108 . . . . 1.45 110.803 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 -89.54 -55.11 3.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.779 -0.646 . . . . 1.8700000000000001 110.833 -174.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -91.42 157.04 17.3 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.148 -0.686 . . . . 3.8199999999999998 109.148 174.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 16.6 p -103.6 108.0 19.08 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.426 0.631 . . . . 2.6699999999999999 110.834 -178.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.4 ' HB2' ' H ' ' A' ' 37' ' ' ALA . 39.4 mt-10 -103.77 -84.25 0.48 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.306 -0.861 . . . . 3.3399999999999999 110.584 -176.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 3' ' ' GLN . . . -101.5 151.65 37.86 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.007 -0.542 . . . . 2.4399999999999999 111.182 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.779 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 32.5 Cg_exo -61.44 169.6 6.43 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.904 2.403 . . . . 1.8700000000000001 110.912 168.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -81.23 -1.8 46.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.347 0.594 . . . . 4.6399999999999997 110.825 -178.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.526 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 170.36 68.42 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.639 -0.71 . . . . 2.3999999999999999 111.798 176.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.855 HG22 ' H ' ' A' ' 42' ' ' GLU . 3.5 t -80.5 -75.36 0.27 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 120.351 -0.54 . . . . 1.45 110.543 -177.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.855 ' H ' HG22 ' A' ' 41' ' ' THR . 13.4 pt-20 -94.45 -32.19 13.64 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 122.384 1.088 . . . . 2.02 109.789 171.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.671 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 51.7 m -62.71 -24.53 67.71 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 113.206 -1.815 . . . . 1.25 114.816 -165.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -39.42 -55.52 1.75 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.517 0.511 . . . . 1.9099999999999999 112.251 -172.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.449 ' HB2' HG23 ' A' ' 152' ' ' VAL . . . -70.52 -40.07 73.72 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.796 0.295 . . . . 1.1799999999999999 111.796 179.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.659 ' HB ' ' HB3' ' A' ' 148' ' ' TRP . 2.0 m -67.74 -44.2 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 121.239 -0.185 . . . . 2.0099999999999998 111.189 -176.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.671 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.8 ptpt -69.93 -39.42 76.12 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.536 -0.542 . . . . 1.3799999999999999 109.536 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.533 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 6.0 mm100 -59.1 -33.62 71.05 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.714 -0.676 . . . . 0.98999999999999999 111.17 174.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.527 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -76.83 -39.41 51.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.39 0.614 . . . . 1.1399999999999999 110.716 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.413 HD11 ' CE2' ' A' ' 151' ' ' PHE . 1.0 OUTLIER -65.79 -25.97 67.48 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.286 -0.87 . . . . 1.95 112.548 -174.63 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.533 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.2 ptp180 -83.34 -27.46 29.7 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.8 0.81 . . . . 2.5099999999999998 109.335 -175.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.505 ' HG2' ' HG3' ' A' ' 51' ' ' ARG . 4.3 mm-40 -80.17 -39.96 28.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.201 -1.363 . . . . 1.1000000000000001 109.715 -179.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.52 -41.57 75.85 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.581 -0.736 . . . . 1.04 109.836 172.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.641 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.13 -31.96 74.65 Favored Glycine 0 C--O 1.222 -0.617 0 CA-C-N 115.533 -0.758 . . . . 0.69999999999999996 111.577 177.052 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -54.26 -39.16 66.6 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 122.591 0.356 . . . . 1.04 111.032 177.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.44 ' HA ' HD21 ' A' ' 59' ' ' LEU . 2.9 tt0 -79.66 -26.48 41.03 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.667 0.746 . . . . 2.29 110.574 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -80.99 -18.41 47.0 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.084 -0.507 . . . . 2.9300000000000002 112.269 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.641 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 40.1 mt-10 -66.95 -68.49 0.37 Allowed 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 120.603 0.24 . . . . 1.3 110.941 -177.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.488 ' HG ' ' N ' ' A' ' 60' ' ' ARG . 1.9 pt? -48.01 -38.78 17.89 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.529 -0.76 . . . . 2.1899999999999999 111.242 178.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.488 ' N ' ' HG ' ' A' ' 59' ' ' LEU . 66.0 mtt180 -54.67 -53.79 50.16 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.041 -0.527 . . . . 3.1400000000000001 111.034 -177.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.414 ' HE2' ' HB1' ' A' ' 102' ' ' ALA . 21.0 m-85 -85.25 -21.3 29.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.987 -0.551 . . . . 5.5899999999999999 110.678 -178.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.77 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 43.5 ttm180 -56.16 -28.5 58.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.12 -0.491 . . . . 4.9299999999999997 110.889 179.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.5 mmt180 -57.52 -55.6 32.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.77 -0.65 . . . . 5.3499999999999996 111.297 176.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.84 -32.78 15.2 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.996 0.739 . . . . 1.7 112.996 -173.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.824 ' HA ' ' HB2' ' A' ' 68' ' ' LEU . 0.3 OUTLIER -61.07 -25.44 66.94 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.813 0.671 . . . . 3.52 112.813 -166.566 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.4 m -63.66 -36.07 82.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.292 0.567 . . . . 2.5899999999999999 110.443 177.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -90.45 -32.41 16.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.493 -0.776 . . . . 2.7200000000000002 109.926 176.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.824 ' HB2' ' HA ' ' A' ' 65' ' ' PHE . 4.0 mp -64.67 -24.83 67.7 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 115.589 -0.732 . . . . 2.25 112.465 -178.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.806 HG21 HG13 ' A' ' 74' ' ' ILE . 2.5 p -61.38 -26.07 67.59 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.498 -0.481 . . . . 1.26 110.731 177.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 29.4 t -72.22 -39.35 68.59 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 109.248 -0.649 . . . . 1.8 109.248 172.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.811 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 9.1 mt-30 -63.62 -52.53 60.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.535 -0.757 . . . . 1.8899999999999999 110.299 178.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.689 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mp -67.5 -31.33 71.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.465 -0.789 . . . . 1.98 110.5 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 64.18 66.22 0.64 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 121.567 0.699 . . . . 3.54 109.464 -173.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.806 HG13 HG21 ' A' ' 69' ' ' THR . 25.3 mm -62.04 117.61 3.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.648 -1.16 . . . . 1.1499999999999999 110.426 178.341 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.75 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -159.57 -172.52 0.33 Allowed Pre-proline 0 C--N 1.316 -0.881 0 N-CA-C 107.723 -1.214 . . . . 1.1200000000000001 107.723 -169.481 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.75 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 38.2 Cg_exo -29.79 166.32 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.959 3.773 . . . . 0.53000000000000003 114.996 164.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.44 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.03 -29.3 0.01 OUTLIER Glycine 0 N--CA 1.475 1.279 0 N-CA-C 117.211 1.644 . . . . 0.40999999999999998 117.211 -175.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.448 ' N ' ' O ' ' A' ' 76' ' ' PRO . 23.9 p -67.71 1.23 2.6 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.949 0.874 . . . . 1.22 112.358 178.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.3 -13.93 61.62 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.101 0.476 . . . . 1.0700000000000001 110.125 171.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.423 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 53.5 t80 -75.28 -22.41 57.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.892 -0.595 . . . . 4.3099999999999996 109.581 175.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -82.7 -27.53 31.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.745 0.783 . . . . 1.03 109.608 174.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.47 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 6.5 m -69.91 -52.48 24.27 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.627 -1.17 . . . . 0.47999999999999998 109.515 172.096 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -66.47 -23.19 66.23 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.098 -0.955 . . . . 1.4399999999999999 110.088 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.562 ' HA ' HG22 ' A' ' 87' ' ' VAL . 30.1 tt0 -55.45 -48.7 74.08 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.159 0.504 . . . . 0.80000000000000004 110.739 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.53 ' OE1' HG21 ' B' 1004 ' ' VAL . 86.3 mt-30 -47.12 -29.78 2.44 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.528 -1.214 . . . . 1.99 111.748 176.119 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.664 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.0 t -90.35 -49.77 13.42 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.131 0 CA-C-N 115.121 -0.945 . . . . 1.8999999999999999 110.199 -173.316 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.562 HG22 ' HA ' ' A' ' 84' ' ' GLU . 0.2 OUTLIER -52.45 -38.69 26.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 122.689 1.233 . . . . 1.4299999999999999 108.878 177.129 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.448 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 4.4 m-80 -62.65 -43.89 97.65 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 112.652 -2.067 . . . . 0.91000000000000003 112.16 -177.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 1.042 ' HB2' ' HB3' ' B' 1009 ' ' ALA . 1.3 pp20? -67.71 -34.51 77.02 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 122.092 0.949 . . . . 2.8700000000000001 108.967 177.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.614 HD11 ' OE2' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -66.9 -24.9 66.16 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-N 113.135 -1.848 . . . . 1.9199999999999999 111.399 -165.729 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.769 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 4.7 p90 -108.49 -35.56 6.45 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 120.329 -0.548 . . . . 2.9700000000000002 111.912 -172.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.448 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 10.3 ptm180 -75.31 -35.21 61.27 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.685 0.755 . . . . 5.6699999999999999 110.675 -171.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.4 ' HB3' HH12 ' A' ' 99' ' ' ARG . 13.6 t70 -87.59 4.27 44.38 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.827 -1.079 . . . . 3.1200000000000001 112.412 -169.431 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 129.67 70.13 0.12 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 117.375 -2.345 . . . . 2.3100000000000001 115.505 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.769 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 64.5 t -69.94 99.22 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-O 122.613 1.197 . . . . 1.6799999999999999 110.93 -179.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.721 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 0.2 OUTLIER -107.45 -179.03 3.8 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 113.402 -1.726 . . . . 2.1200000000000001 107.726 168.033 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.604 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 15.2 m-90 -49.7 -40.87 41.83 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 123.36 0.412 . . . . 4.1200000000000001 111.569 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.524 ' HA3' HG22 ' B' 1015 ' ' ILE . . . -64.76 -41.01 97.8 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 114.574 0.59 . . . . 0.80000000000000004 114.574 -175.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.721 ' HG2' ' ND2' ' A' ' 96' ' ' ASN . 13.9 mmt85 -58.79 -43.27 90.42 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.21 0.529 . . . . 4.9100000000000001 111.123 -175.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 70.3 mt -68.89 -41.0 81.87 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.533 -0.758 . . . . 1.1100000000000001 110.622 -176.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 97' ' ' TRP . 63.0 t -54.45 -54.58 20.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.024 -0.535 . . . . 2.0299999999999998 109.856 171.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.414 ' HB1' ' HE2' ' A' ' 61' ' ' TYR . . . -52.33 -45.78 65.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.015 -0.993 . . . . 1.0600000000000001 111.384 177.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.607 ' HZ ' ' HA ' ' A' ' 130' ' ' MET . 42.5 t80 -55.21 -39.63 69.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.749 . . . . 1.8400000000000001 111.25 178.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.923 ' HZ ' HD13 ' A' ' 134' ' ' LEU . 27.0 m-85 -78.47 -35.69 46.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.683 0.278 . . . . 4.21 111.116 177.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.733 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 23.1 m -63.69 -47.47 81.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.241 -0.436 . . . . 1.55 110.658 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.417 ' HE1' ' HB2' ' A' ' 65' ' ' PHE . 50.1 t80 -81.74 -29.29 32.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.022 -0.536 . . . . 3.6400000000000001 110.618 -178.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.46 -47.72 61.3 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.769 -0.729 . . . . 0.32000000000000001 111.285 175.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.932 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -64.92 -28.59 73.66 Favored Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 111.466 -0.654 . . . . 0.23999999999999999 111.466 176.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.1 -32.75 61.51 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.295 -0.261 . . . . 1.05 110.295 176.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.415 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -68.29 -36.25 79.08 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-O 121.896 0.855 . . . . 1.78 109.494 -179.01 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.691 ' SG ' HG11 ' A' ' 123' ' ' VAL . 24.5 t -49.34 -50.88 37.8 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 113.77 -1.559 . . . . 0.90000000000000002 109.579 171.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.539 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 96.4 t -67.27 -34.43 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 115.634 -0.712 . . . . 1.2 110.945 177.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.6 ' HB3' HG22 ' A' ' 74' ' ' ILE . 7.8 mm-40 -59.87 -28.98 68.0 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.388 0.614 . . . . 2.5099999999999998 110.5 177.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.488 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 18.3 m -78.89 -39.61 34.53 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.347 -0.842 . . . . 0.28000000000000003 109.082 177.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.643 HG22 ' O ' ' A' ' 111' ' ' CYS . 96.4 t -67.37 -34.66 70.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.985 0.898 . . . . 1.8300000000000001 109.634 -177.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -54.78 -50.79 67.62 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.584 -1.644 . . . . 0.59999999999999998 111.25 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 24.6 mmtt -86.33 12.75 9.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.717 -0.674 . . . . 2.1600000000000001 110.055 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.39 52.07 4.98 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.87 0.843 . . . . 1.8799999999999999 110.971 -178.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.551 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 25.9 mtm -125.74 44.52 2.81 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.394 -1.276 . . . . 1.0800000000000001 107.883 178.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.447 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 5.8 mt-30 -60.02 -8.13 2.17 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.763 1.023 . . . . 1.1499999999999999 113.763 -173.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.551 HG23 HD22 ' A' ' 122' ' ' LEU . 27.1 m -66.81 -24.5 32.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 O-C-N 122.008 -0.432 . . . . 1.1899999999999999 110.904 175.394 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.767 HD12 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -71.3 -26.85 63.04 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 116.434 -0.348 . . . . 1.0600000000000001 110.338 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.691 HG11 ' SG ' ' A' ' 111' ' ' CYS . 69.1 t -46.86 -54.64 2.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 123.576 0.548 . . . . 1.0 111.64 178.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.571 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 2.5 t -70.79 -29.57 65.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.738 0.304 . . . . 1.6599999999999999 110.757 -179.161 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.767 ' HD2' HD12 ' A' ' 122' ' ' LEU . 73.8 mtt180 -69.31 -54.37 14.93 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.029 0.442 . . . . 3.2999999999999998 110.436 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.587 HG22 ' SD ' ' A' ' 130' ' ' MET . 73.0 mt -56.01 -52.02 54.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.618 -0.719 . . . . 1.0600000000000001 110.451 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.813 ' HB1' HD23 ' A' ' 13' ' ' LEU . . . -58.02 -33.73 69.27 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 120.889 0.376 . . . . 1.1000000000000001 111.599 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.541 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -62.21 -62.31 1.86 Allowed 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 121.124 0.488 . . . . 1.1200000000000001 110.379 176.283 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -62.07 -32.95 73.54 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.05 -0.977 . . . . 4.7699999999999996 111.617 -175.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.607 ' HA ' ' HZ ' ' A' ' 103' ' ' PHE . 88.9 mtp -61.63 -53.57 54.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.981 0.419 . . . . 1.0900000000000001 110.837 178.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.512 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -63.82 -39.07 93.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.046 -0.524 . . . . 1.05 110.982 179.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 86.3 m -63.66 -47.49 81.06 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.454 -0.339 . . . . 1.1299999999999999 111.074 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.443 ' CE2' HG11 ' A' ' 87' ' ' VAL . 52.2 t80 -57.21 -39.69 75.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.506 -0.315 . . . . 3.3500000000000001 110.403 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.942 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 4.8 tt -58.32 -54.26 49.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.365 -0.976 . . . . 1.5900000000000001 108.365 172.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -52.73 -46.31 67.35 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.229 -0.896 . . . . 0.46000000000000002 112.194 -177.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -80.13 -59.19 2.81 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.319 0.58 . . . . 0.58999999999999997 111.509 -176.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -92.62 -47.44 7.1 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 113.354 0.872 . . . . 2.3399999999999999 113.354 -168.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.942 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -80.25 -43.35 21.52 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 113.502 0.927 . . . . 1.8999999999999999 113.502 -166.636 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.654 ' HA ' HD11 ' A' ' 142' ' ' ILE . 32.9 tt0 -45.27 -53.11 18.65 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 112.919 0.711 . . . . 0.75 112.919 -175.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.52 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 19.6 Cg_endo -58.62 -45.29 30.66 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.693 1.595 . . . . 0.87 111.718 178.267 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -61.5 -42.58 99.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.419 -0.809 . . . . 1.4299999999999999 110.547 178.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.654 HD11 ' HA ' ' A' ' 139' ' ' GLU . 28.1 mt -52.11 -49.16 40.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.876 -0.602 . . . . 1.1299999999999999 110.83 174.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.61 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 71.1 mm-40 -63.06 -25.86 68.57 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.547 -0.751 . . . . 0.57999999999999996 111.324 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.52 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.6 mm-40 -68.15 -22.27 64.86 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.447 0.641 . . . . 0.78000000000000003 110.0 174.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.595 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -105.03 4.08 31.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.149 -0.932 . . . . 0.93000000000000005 109.785 -174.906 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 111.41 -43.28 1.75 Allowed Glycine 0 N--CA 1.442 -0.935 0 CA-C-N 115.385 -0.825 . . . . 0.56000000000000005 112.437 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . 0.557 ' HA2' HG21 ' A' ' 142' ' ' ILE . . . 128.6 -176.88 18.08 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.368 -0.92 . . . . 0.48999999999999999 112.808 178.284 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.659 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 8.5 m-90 -70.76 -38.48 73.46 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 122.683 0.393 . . . . 4.5199999999999996 110.843 -178.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -61.35 -45.05 96.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.938 0.399 . . . . 1.96 110.197 178.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.537 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 93.4 m -59.13 -35.41 73.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.853 -0.612 . . . . 1.24 111.477 178.037 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.604 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 88.4 t80 -60.96 -42.01 97.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.802 0.335 . . . . 3.7200000000000002 110.509 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.449 HG23 ' HB2' ' A' ' 45' ' ' ALA . 1.6 m -71.59 -25.09 24.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 1.8600000000000001 110.27 179.037 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.484 ' HB2' ' O ' ' A' ' 150' ' ' THR . 19.2 mm-40 -62.19 -30.36 71.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.88 0.371 . . . . 1.6699999999999999 110.33 171.409 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.7 mt -90.52 -62.05 1.54 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.135 -0.484 . . . . 1.96 110.941 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -123.64 29.65 6.5 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.451 0.643 . . . . 4.3899999999999997 110.721 -175.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.527 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -58.16 165.81 7.03 Favored Glycine 0 CA--C 1.499 -0.917 0 CA-C-N 115.474 -0.785 . . . . 1.1000000000000001 113.759 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.458 ' CB ' ' HB3' ' A' ' 48' ' ' GLN . 27.4 t-20 -64.38 109.77 2.03 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 113.888 -1.156 . . . . 1.29 110.837 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.687 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 9.5 m120 -82.71 -21.23 34.88 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.068 -0.514 . . . . 3.4399999999999999 111.058 -178.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -54.42 -47.66 72.56 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.491 0.494 . . . . 2.6699999999999999 110.829 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -81.15 -35.74 31.11 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.105 -0.498 . . . . 2.8700000000000001 110.714 176.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 0.543 ' HB1' ' HA ' ' A' ' 158' ' ' ASN . . . -54.29 -59.81 4.17 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.08 -0.509 . . . . 3.2000000000000002 111.628 -178.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.687 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 8.0 pt-20 -58.84 -33.89 70.93 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.622 0.249 . . . . 3.7200000000000002 111.417 178.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 72.0 m -66.14 -36.17 82.43 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.933 0.397 . . . . 4.2000000000000002 110.676 -178.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 26.7 mmm180 -80.14 -28.05 38.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.655 0.74 . . . . 6.3700000000000001 109.822 175.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -74.33 -19.17 60.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.657 -1.156 . . . . 5.0099999999999998 110.872 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -61.79 -37.5 94.41 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 121.066 -0.588 . . . . 5.0999999999999996 112.491 -177.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -82.36 -23.89 34.79 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.29 0.566 . . . . 5.9400000000000004 110.148 176.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -74.01 -8.41 56.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.714 -0.675 . . . . 5.8799999999999999 110.185 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.54 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 0.4 OUTLIER -73.3 -38.31 65.91 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.608 -0.886 . . . . 7.7999999999999998 108.608 176.96 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.491 HD21 ' HB3' ' A' ' 169' ' ' ARG . 2.8 mm? -95.65 -18.0 20.87 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.361 -0.836 . . . . 7.29 109.931 -179.016 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 65.76 179.5 0.2 Allowed 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.319 -0.855 . . . . 6.9699999999999998 111.349 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 7.7 p80 -130.17 86.49 2.4 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 108.533 -0.914 . . . . 9.8100000000000005 108.533 171.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -85.68 134.3 33.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.717 -1.129 . . . . 11.99 111.732 -169.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -95.96 164.1 12.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.584 -0.735 . . . . 11.949999999999999 109.306 175.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 20.5 t-80 -95.08 86.63 4.66 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.079 0.466 . . . . 14.949999999999999 110.066 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 33.7 t-80 -94.27 -40.22 10.1 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.28 -0.637 . . . . 15.880000000000001 109.28 177.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -69.23 150.33 47.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.638 -0.71 . . . . 16.02 109.344 173.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 6.4 mp -91.98 160.19 15.37 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.786 0.327 . . . . 18.210000000000001 110.407 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -76.17 -21.05 56.98 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.358 0.599 . . . . 19.219999999999999 109.487 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 22.5 p80 -122.62 117.37 25.67 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.223 -0.899 . . . . 22.800000000000001 108.908 173.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -135.95 24.06 3.32 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.481 -0.327 . . . . 22.510000000000002 111.658 -177.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 46.7 m80 -74.6 86.93 2.13 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.282 -0.636 . . . . 25.300000000000001 109.282 172.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 32.7 t-80 -76.05 -24.55 55.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.092 -0.503 . . . . 25.77 110.383 -176.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 47.9 t-80 56.34 81.49 0.13 Allowed 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.68 -0.691 . . . . 27.370000000000001 109.87 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.134 -0.936 . . . . 29.52 109.843 -175.194 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.257 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -117.41 26.72 8.0 Favored Glycine 0 N--CA 1.448 -0.555 0 O-C-N 121.472 -0.768 . . . . 2.9900000000000002 112.422 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.597 ' HB3' ' HE ' ' B' 1006 ' ' ARG . 68.9 m -106.06 86.35 2.36 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.008 0.432 . . . . 1.9399999999999999 111.416 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.909 HG22 ' H ' ' B' 1005 ' ' GLY . 5.8 m -134.92 -77.94 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.367 0 CA-C-N 115.983 -0.553 . . . . 1.9399999999999999 110.153 167.038 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 0.909 ' H ' HG22 ' B' 1004 ' ' VAL . . . -61.07 58.97 0.01 OUTLIER Glycine 0 CA--C 1.526 0.721 0 C-N-CA 121.265 -0.493 . . . . 1.26 113.293 169.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B 1006 ' ' ARG . . . . . 1.078 ' HG3' ' H1 ' ' B' 1100 ' ' 33B . 0.0 OUTLIER -145.79 -29.56 0.42 Allowed 'General case' 0 C--O 1.215 -0.746 0 C-N-CA 122.787 0.435 . . . . 3.4500000000000002 110.344 175.888 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B 1007 ' ' ALA . . . . . 0.826 ' H ' ' HD3' ' B' 1006 ' ' ARG . . . -120.33 -27.3 5.26 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-N 115.984 -0.553 . . . . 1.54 110.708 -176.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.435 ' HG ' HG13 ' A' ' 86' ' ' VAL . 2.7 mm? -61.02 -46.77 89.39 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 106.069 -1.826 . . . . 1.8999999999999999 106.069 165.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 1.042 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . . . -53.97 -56.9 13.53 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 113.629 -1.623 . . . . 1.45 111.832 167.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.713 ' HB3' ' C13' ' B' 1100 ' ' 33B . . . -67.44 -54.33 21.2 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.165 -0.925 . . . . 1.51 112.908 -171.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.769 ' HE1' ' N10' ' B' 1100 ' ' 33B . 5.7 m-30 -66.0 -26.69 67.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.311 -0.404 . . . . 2.0699999999999998 110.131 -176.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -87.5 1.01 85.64 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.662 -0.699 . . . . 0.80000000000000004 113.458 -176.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 4.1 t70 -89.48 -3.21 58.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.162 0.506 . . . . 1.8999999999999999 110.246 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 3.2 m -93.74 92.22 7.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.949 -0.568 . . . . 1.4399999999999999 110.357 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.524 HG22 ' HA3' ' A' ' 98' ' ' GLY . 1.3 pp -140.83 37.62 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 112.059 0.392 . . . . 3.4300000000000002 112.059 -178.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -109.28 104.65 13.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.255 -0.43 . . . . 4.79 110.032 176.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 1017 ' ' ARG . . . . . 0.42 HH11 ' HD3' ' B' 1017 ' ' ARG . 15.8 ttm180 -114.54 98.16 6.72 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.818 -0.628 . . . . 8.9800000000000004 110.272 -178.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.566 0 CA-C-N 116.485 -0.325 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 1.078 ' H1 ' ' HG3' ' B' 1006 ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.9 ptp . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 120.503 0.192 . . . . 6.4500000000000002 111.187 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.7 m -100.04 137.98 37.74 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.773 0.32 . . . . 2.2599999999999998 110.746 -176.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.1 mp0 -101.51 -8.85 21.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.349 0.595 . . . . 2.7599999999999998 109.601 175.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.512 ' O ' HD13 ' A' ' 8' ' ' LEU . 1.5 p -68.66 -22.71 64.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.509 -0.769 . . . . 1.54 111.554 -178.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.487 ' HB3' HD22 ' A' ' 134' ' ' LEU . 3.1 p30 -62.72 -24.17 67.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.103 -0.499 . . . . 1.78 110.404 175.057 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.521 ' O ' HG22 ' A' ' 10' ' ' VAL . 3.9 tpp180 -61.53 -44.64 96.69 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.766 -0.652 . . . . 1.8999999999999999 109.832 174.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.479 ' HB3' ' HZ2' ' A' ' 47' ' ' LYS . 42.6 mt-10 -56.1 -57.85 10.4 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 115.554 -0.748 . . . . 0.68000000000000005 110.166 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.512 HD13 ' O ' ' A' ' 4' ' ' SER . 5.8 mp -41.53 -50.25 4.01 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.647 -1.161 . . . . 1.8 111.098 178.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.471 HG21 ' N ' ' A' ' 131' ' ' ALA . 79.0 t -64.66 -59.5 4.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.51 -0.313 . . . . 1.0700000000000001 111.04 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.521 HG22 ' O ' ' A' ' 6' ' ' ARG . 85.4 t -54.13 -48.14 65.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.135 -0.484 . . . . 1.1299999999999999 112.122 -175.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -51.09 -43.83 61.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.93 -0.577 . . . . 0.58999999999999997 110.808 -177.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.633 ' HB2' ' CE2' ' A' ' 104' ' ' PHE . 6.1 t80 -81.59 -41.34 21.69 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.19 -0.459 . . . . 2.02 111.679 -175.118 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 1.0 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 3.8 mp -60.46 -40.21 90.39 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 119.771 -0.772 . . . . 1.0600000000000001 109.745 178.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.468 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 48.5 t -64.07 -46.5 84.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.673 -0.694 . . . . 1.6000000000000001 110.067 175.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -60.36 -32.22 71.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.518 -0.764 . . . . 1.49 110.9 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.676 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 6.4 mmpt? -75.61 -33.19 60.51 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 111.839 0.311 . . . . 1.8400000000000001 111.839 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.599 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -62.22 -27.72 69.19 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.736 -0.786 . . . . 1.98 109.788 175.163 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.9 t -65.61 -30.33 71.04 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.379 -0.828 . . . . 1.3799999999999999 112.219 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.676 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 13.4 pt20 -74.92 -9.24 58.36 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.773 0.657 . . . . 1.51 112.773 -172.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.748 ' NZ ' HG11 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -119.24 -19.94 8.14 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 121.918 0.866 . . . . 2.6499999999999999 109.549 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.51 26.4 6.89 Favored Glycine 0 C--N 1.306 -1.086 0 CA-C-N 113.945 -1.48 . . . . 0.54000000000000004 113.058 173.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -104.98 171.23 7.43 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.612 0.244 . . . . 1.1200000000000001 110.555 170.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.588 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 8.3 t -110.67 157.63 19.51 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.104 0.478 . . . . 0.75 110.861 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.524 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 65.6 t-105 -75.92 -52.05 11.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.516 -0.766 . . . . 4.29 110.172 174.041 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m -67.21 -19.91 65.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.579 -0.737 . . . . 1.8600000000000001 111.685 -174.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.588 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 51.3 mt-30 -51.93 -38.7 57.36 Favored 'General case' 0 N--CA 1.461 0.092 0 N-CA-C 111.793 0.294 . . . . 1.52 111.793 177.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -121.93 -4.15 9.11 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.831 0.678 . . . . 1.53 112.831 -178.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.406 ' HB3' HG23 ' A' ' 30' ' ' VAL . 19.8 m -102.16 149.23 24.49 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 122.026 0.917 . . . . 2.04 112.094 -178.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -124.37 -1.71 8.09 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 113.594 -1.639 . . . . 2.3100000000000001 109.015 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.627 HG22 ' H ' ' A' ' 31' ' ' GLU . 4.6 m -58.75 -73.7 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 113.889 -1.505 . . . . 1.4099999999999999 112.801 -168.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.627 ' H ' HG22 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -90.73 0.06 57.54 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.481 0.658 . . . . 2.7400000000000002 109.868 177.262 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -72.56 -44.92 61.45 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 114.774 -1.103 . . . . 1.45 110.857 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -103.03 -31.59 10.12 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.961 -0.563 . . . . 1.8700000000000001 111.435 -174.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.598 ' O ' ' HA ' ' A' ' 31' ' ' GLU . 51.3 ptt85 -137.22 155.13 49.89 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.327 -0.397 . . . . 3.8199999999999998 110.322 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.9 p -137.43 112.54 9.11 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.304 0.574 . . . . 2.6699999999999999 111.175 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -80.52 -72.15 0.43 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.603 -0.726 . . . . 3.3399999999999999 110.19 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -95.42 148.07 34.03 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.717 -0.674 . . . . 2.4399999999999999 109.823 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.543 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 71.5 Cg_exo -51.39 163.35 1.08 Allowed 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 123.317 2.678 . . . . 1.8700000000000001 112.574 174.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -70.01 -2.8 13.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.402 -0.363 . . . . 4.6399999999999997 111.841 -178.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 175.54 63.65 0.06 OUTLIER Glycine 0 N--CA 1.443 -0.853 0 C-N-CA 120.833 -0.699 . . . . 2.3999999999999999 111.967 175.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.703 HG21 ' H ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -75.8 -75.51 0.18 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.424 -0.51 . . . . 1.45 110.28 -177.729 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.703 ' H ' HG21 ' A' ' 41' ' ' THR . 14.3 pt-20 -93.85 -31.24 14.42 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.011 0.91 . . . . 2.02 109.892 173.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.73 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 57.7 m -63.66 -25.11 68.07 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 113.653 -1.612 . . . . 1.25 113.261 -170.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -40.12 -50.8 2.65 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 123.613 0.571 . . . . 1.9099999999999999 112.314 -173.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.82 -40.05 41.75 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.931 -0.308 . . . . 1.1799999999999999 111.652 176.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.641 ' HB ' ' HB3' ' A' ' 148' ' ' TRP . 1.9 m -65.12 -46.13 92.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 121.284 -0.166 . . . . 2.0099999999999998 111.381 -176.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.73 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.8 ptpt -68.34 -40.27 81.64 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.457 -0.571 . . . . 1.3799999999999999 109.457 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.682 HE21 ' HA ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -58.34 -38.4 77.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.414 -0.812 . . . . 0.98999999999999999 111.086 174.882 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.455 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -72.06 -41.57 67.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.4 0.619 . . . . 1.1399999999999999 110.981 176.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.547 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.1 tp -65.98 -24.83 66.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.318 -0.856 . . . . 1.95 112.087 -174.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.607 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 7.6 ptp180 -85.63 -25.91 26.34 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 121.705 0.764 . . . . 2.5099999999999998 109.491 -177.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.789 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 7.5 mm-40 -69.57 -47.54 63.26 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.705 -1.134 . . . . 1.1000000000000001 109.282 173.025 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 56' ' ' GLU . . . -66.81 -33.19 75.07 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.084 -0.962 . . . . 1.04 110.173 174.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.652 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -59.06 -46.44 93.74 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.371 -0.692 . . . . 0.69999999999999996 111.371 176.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.623 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 30.4 t70 -63.26 -37.29 86.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.963 0.411 . . . . 1.04 110.283 176.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.447 ' HB3' ' O ' ' A' ' 53' ' ' ALA . 14.6 tp10 -60.48 -28.15 68.12 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.34 -0.845 . . . . 2.29 110.469 176.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.692 ' HZ ' ' HB3' ' B' 1008 ' ' LEU . 49.8 t80 -81.9 -46.56 13.9 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.322 -0.854 . . . . 2.9300000000000002 110.771 174.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.737 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 46.3 mt-10 -60.13 -57.67 11.8 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.504 -0.771 . . . . 1.3 112.76 -170.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.66 HD13 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -43.32 -41.47 4.06 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.853 1.057 . . . . 2.1899999999999999 113.853 -172.851 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.66 ' H ' HD13 ' A' ' 59' ' ' LEU . 72.5 mtt85 -67.81 -45.71 73.96 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.011 0.374 . . . . 3.1400000000000001 112.011 -175.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.737 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 5.0 p90 -92.42 -3.87 54.59 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.731 -0.213 . . . . 5.5899999999999999 111.159 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.9 tpp180 -43.36 -49.52 6.94 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.361 0.664 . . . . 4.9299999999999997 112.578 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -67.21 -13.51 62.03 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.209 0.448 . . . . 5.3499999999999996 112.209 -175.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.484 ' O ' HD12 ' A' ' 68' ' ' LEU . . . -92.14 -26.6 18.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.842 0.312 . . . . 1.7 111.842 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.602 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 81.3 t80 -48.96 -46.45 43.48 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.078 0.77 . . . . 3.52 113.078 -170.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.8 t -68.03 -40.14 82.96 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.913 0.387 . . . . 2.5899999999999999 110.896 -175.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -71.2 -39.45 71.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.049 -0.523 . . . . 2.7200000000000002 111.006 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.484 HD12 ' O ' ' A' ' 64' ' ' ALA . 3.7 mp -64.81 -20.46 66.4 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 113.211 0.819 . . . . 2.25 113.211 -171.121 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.537 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 3.2 p -57.45 -35.49 70.19 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.064 0.847 . . . . 1.26 111.16 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.0 t -71.93 -25.36 61.86 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.54 -0.754 . . . . 1.8 109.528 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.479 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 9.2 mt-30 -83.82 -38.01 21.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.223 -0.898 . . . . 1.8899999999999999 110.133 -178.524 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.562 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.8 mm? -65.96 -32.99 74.8 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.734 -0.469 . . . . 1.98 109.734 170.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.44 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 50.6 m80 68.16 41.77 1.89 Allowed 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.144 -1.058 . . . . 3.54 108.144 -173.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.591 HG21 ' HE3' ' A' ' 119' ' ' MET . 28.0 mm -50.44 117.15 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 113.322 -1.763 . . . . 1.1499999999999999 111.931 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.761 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.46 -171.48 0.28 Allowed Pre-proline 0 N--CA 1.441 -0.913 0 N-CA-C 107.43 -1.322 . . . . 1.1200000000000001 107.43 -173.097 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.761 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.7 Cg_exo -28.86 166.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 125.017 3.811 . . . . 0.53000000000000003 115.355 164.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.527 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -29.09 -28.75 0.01 OUTLIER Glycine 0 N--CA 1.472 1.074 0 N-CA-C 117.937 1.935 . . . . 0.40999999999999998 117.937 -170.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.471 ' N ' ' O ' ' A' ' 76' ' ' PRO . 41.7 p -66.72 5.8 0.57 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 118.31 1.055 . . . . 1.22 112.339 -178.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.401 ' H ' ' C ' ' A' ' 77' ' ' GLY . . . -69.9 -12.43 61.61 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.975 0.417 . . . . 1.0700000000000001 110.096 174.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.527 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 10.4 p90 -76.33 -17.3 59.49 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.427 0.632 . . . . 4.3099999999999996 109.349 174.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.431 ' HB2' ' O ' ' A' ' 78' ' ' THR . 35.7 mt-30 -84.91 -20.02 31.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.101 -0.954 . . . . 1.03 109.698 174.015 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.0 m -82.04 -53.28 6.25 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.531 -1.213 . . . . 0.47999999999999998 109.667 173.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.782 ' HA ' HG22 ' A' ' 86' ' ' VAL . 78.3 t80 -63.09 -16.68 60.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.326 -0.852 . . . . 1.4399999999999999 110.111 174.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.535 ' HA ' HG13 ' A' ' 87' ' ' VAL . 40.3 tt0 -54.68 -50.23 68.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.205 -0.907 . . . . 0.80000000000000004 110.374 173.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -49.94 -32.15 14.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.986 -1.006 . . . . 1.99 110.888 177.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.847 HG11 HD13 ' B' 1008 ' ' LEU . 1.8 t -80.93 -53.49 12.31 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-N 114.733 -1.121 . . . . 1.8999999999999999 110.443 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.535 HG13 ' HA ' ' A' ' 84' ' ' GLU . 8.9 p -60.98 -23.55 30.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.815 0.817 . . . . 1.4299999999999999 109.337 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.6 m-80 -78.06 -38.87 43.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.338 -1.301 . . . . 0.91000000000000003 112.089 176.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 1.123 ' HB2' ' HB1' ' B' 1009 ' ' ALA . 1.0 OUTLIER -73.84 -32.38 63.65 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.343 -0.984 . . . . 2.8700000000000001 108.343 178.805 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.624 HD11 ' OE2' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -67.61 -44.02 79.06 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.553 -1.203 . . . . 1.9199999999999999 110.233 -174.059 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -99.14 10.18 41.96 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.496 -0.774 . . . . 2.9700000000000002 111.066 -169.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.852 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.09 -23.47 66.54 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.108 -0.496 . . . . 5.6699999999999999 110.542 178.301 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -96.44 -31.11 12.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 122.068 0.937 . . . . 3.1200000000000001 109.186 169.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.563 ' O ' HG21 ' A' ' 95' ' ' VAL . . . 130.79 -42.1 1.44 Allowed Glycine 0 C--N 1.312 -0.79 0 CA-C-N 113.862 -1.517 . . . . 2.3100000000000001 113.234 165.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.592 HG23 ' CD2' ' A' ' 138' ' ' LEU . 1.6 t 168.2 131.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 C-N-CA 125.079 1.352 . . . . 1.6799999999999999 110.582 157.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.555 ' H ' ' CB ' ' A' ' 99' ' ' ARG . 2.0 m120 -111.16 170.07 8.35 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.387 -0.824 . . . . 2.1200000000000001 109.313 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.547 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 16.9 m-90 -54.76 -58.05 9.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.933 0.396 . . . . 4.1200000000000001 110.713 175.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.549 ' HA3' ' HB ' ' B' 1015 ' ' ILE . . . -70.2 -13.94 70.79 Favored Glycine 0 CA--C 1.518 0.272 0 CA-C-N 115.93 -0.577 . . . . 0.80000000000000004 112.689 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.555 ' CB ' ' H ' ' A' ' 96' ' ' ASN . 18.2 tpp180 -69.35 -43.2 74.1 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.078 0.466 . . . . 4.9100000000000001 110.97 -176.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 90.2 mt -64.67 -40.26 88.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.731 -0.668 . . . . 1.1100000000000001 110.547 -178.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.551 ' O ' ' HD1' ' A' ' 104' ' ' PHE . 0.5 OUTLIER -63.97 -38.19 81.76 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 CA-C-N 116.204 -0.453 . . . . 2.0299999999999998 110.322 175.592 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.1 -46.44 89.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.354 0.597 . . . . 1.0600000000000001 110.217 176.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.42 ' HA ' HD22 ' A' ' 90' ' ' LEU . 36.7 t80 -58.22 -50.0 75.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.81 -1.087 . . . . 1.8400000000000001 111.284 177.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.875 ' HA ' ' HE1' ' A' ' 130' ' ' MET . 0.0 OUTLIER -76.49 -20.04 57.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.808 0.337 . . . . 4.21 110.948 -176.32 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.601 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 37.3 t -75.67 -55.98 5.13 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.261 -0.427 . . . . 1.55 110.304 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -66.49 -26.66 67.28 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 109.448 -0.575 . . . . 3.6400000000000001 109.448 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.548 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.11 -38.53 95.42 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 121.09 -0.576 . . . . 0.32000000000000001 111.735 174.036 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 1.0 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -68.77 -35.4 79.93 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.587 -0.816 . . . . 0.23999999999999999 111.076 174.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.602 ' HB2' ' CE1' ' A' ' 65' ' ' PHE . . . -67.81 -33.3 74.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.366 -0.417 . . . . 1.05 110.627 176.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.439 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -60.93 -37.42 82.25 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 122.221 1.01 . . . . 1.78 108.708 -178.854 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.628 ' SG ' HG13 ' A' ' 123' ' ' VAL . 35.3 t -58.69 -53.74 54.98 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.038 -1.437 . . . . 0.90000000000000002 110.148 174.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.748 HG11 ' NZ ' ' A' ' 20' ' ' LYS . 80.7 t -60.18 -40.79 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 116.619 -0.264 . . . . 1.2 110.914 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.537 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 35.6 mt-10 -54.45 -38.22 66.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.011 0.434 . . . . 2.5099999999999998 110.611 176.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 48.0 m -74.38 -38.78 63.06 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.491 0.663 . . . . 0.28000000000000003 109.543 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.627 HG22 ' O ' ' A' ' 111' ' ' CYS . 92.0 t -69.31 -30.31 45.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.114 -0.948 . . . . 1.8300000000000001 109.783 -177.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.81 -49.79 74.32 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 113.641 -1.618 . . . . 0.59999999999999998 111.027 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.44 ' CG ' ' HE2' ' A' ' 119' ' ' MET . 25.8 mmtt -87.4 11.96 13.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.439 -0.801 . . . . 2.1600000000000001 110.278 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 61.32 50.9 4.49 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 122.044 0.926 . . . . 1.8799999999999999 110.556 -178.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.591 ' HE3' HG21 ' A' ' 74' ' ' ILE . 24.3 mtm -125.63 46.91 2.3 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.255 -1.339 . . . . 1.0800000000000001 107.565 176.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.624 ' HG2' ' HA ' ' A' ' 115' ' ' VAL . 27.8 mt-30 -68.44 -5.79 21.19 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.083 -0.962 . . . . 1.1499999999999999 111.142 -172.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.641 HG23 HD21 ' A' ' 122' ' ' LEU . 25.8 m -58.02 -24.65 24.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 122.142 -0.349 . . . . 1.1899999999999999 110.895 172.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.7 HD12 ' HD2' ' A' ' 125' ' ' ARG . 3.0 mm? -76.06 -26.8 56.9 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.481 -0.327 . . . . 1.0600000000000001 110.391 178.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.628 HG13 ' SG ' ' A' ' 111' ' ' CYS . 78.8 t -45.63 -57.62 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 O-C-N 123.806 0.691 . . . . 1.0 111.707 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -21.45 57.62 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.787 -0.642 . . . . 1.6599999999999999 111.639 -176.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.7 ' HD2' HD12 ' A' ' 122' ' ' LEU . 86.7 mtt180 -72.35 -58.22 3.57 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.924 -0.58 . . . . 3.2999999999999998 110.385 175.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.624 ' HA ' ' CE2' ' A' ' 129' ' ' TRP . 86.9 mt -48.25 -49.41 12.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.426 -0.806 . . . . 1.0600000000000001 111.595 -176.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.524 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -59.64 -26.3 65.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.09 0.404 . . . . 1.1000000000000001 112.09 -177.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.18 -65.13 0.71 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.496 0.665 . . . . 1.1200000000000001 110.046 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.624 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 38.7 p-90 -75.16 -17.85 60.31 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.04 -0.982 . . . . 4.7699999999999996 111.747 -175.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.875 ' HE1' ' HA ' ' A' ' 104' ' ' PHE . 13.3 mmm -62.21 -57.67 10.59 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 120.967 0.413 . . . . 1.0900000000000001 110.248 170.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.471 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -64.0 -38.29 90.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.883 -0.598 . . . . 1.05 110.538 179.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.488 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 89.1 m -60.78 -43.56 97.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.399 -0.364 . . . . 1.1299999999999999 111.534 176.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -60.88 -39.9 90.99 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.775 -0.454 . . . . 3.3500000000000001 109.775 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.487 HD22 ' HB3' ' A' ' 5' ' ' ASN . 5.4 tt -62.18 -50.87 70.1 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.603 -0.888 . . . . 1.5900000000000001 108.603 173.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -48.69 -56.74 7.69 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.977 -0.556 . . . . 0.46000000000000002 112.41 179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -78.06 -49.74 13.4 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.043 0.449 . . . . 0.58999999999999997 111.88 -174.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -91.3 -50.81 5.61 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 112.788 0.662 . . . . 2.3399999999999999 112.788 -169.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.592 ' CD2' HG23 ' A' ' 95' ' ' VAL . 53.7 mt -86.29 -34.68 20.28 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 112.729 0.64 . . . . 1.8999999999999999 112.729 -166.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.62 ' HA ' HD11 ' A' ' 142' ' ' ILE . 21.0 tt0 -49.84 -51.39 61.09 Favored Pre-proline 0 CA--C 1.539 0.545 0 O-C-N 123.198 0.311 . . . . 0.75 111.707 -174.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.567 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 24.6 Cg_exo -63.42 -43.3 18.32 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 121.934 1.756 . . . . 0.87 111.951 176.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 5.6 t-105 -59.45 -47.35 85.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.418 -0.81 . . . . 1.4299999999999999 110.223 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.62 HD11 ' HA ' ' A' ' 139' ' ' GLU . 37.4 mt -48.39 -51.58 10.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.592 -0.731 . . . . 1.1299999999999999 111.095 174.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.618 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 70.1 mm-40 -57.15 -35.25 69.29 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.718 -0.673 . . . . 0.57999999999999996 111.303 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 9.5 mm-40 -64.8 -21.54 66.8 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.437 0.637 . . . . 0.78000000000000003 111.307 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -110.65 9.21 22.91 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.256 -0.884 . . . . 0.93000000000000005 110.105 -174.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 116.43 -47.52 1.03 Allowed Glycine 0 N--CA 1.441 -1.029 0 CA-C-N 114.78 -1.1 . . . . 0.56000000000000005 112.704 174.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . 0.563 ' HA2' HG21 ' A' ' 142' ' ' ILE . . . 132.01 -177.24 18.82 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.761 -0.733 . . . . 0.48999999999999999 111.961 -177.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.641 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 13.6 m-90 -71.01 -37.95 72.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.019 0.438 . . . . 4.5199999999999996 110.258 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.6 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 6.2 m-20 -64.07 -31.49 72.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.638 -0.71 . . . . 1.96 110.339 178.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.578 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 87.0 m -67.34 -40.04 85.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.068 -0.515 . . . . 1.24 111.508 179.348 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.547 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 85.3 t80 -64.72 -31.06 72.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.797 0.808 . . . . 3.7200000000000002 109.104 -178.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.6 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 87.4 t -59.67 -50.24 80.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 114.422 -1.263 . . . . 1.8600000000000001 110.35 172.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.79 -28.45 64.01 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.829 -1.078 . . . . 1.6699999999999999 111.518 176.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 150' ' ' THR . 10.2 mt -86.37 -56.13 3.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.458 -0.337 . . . . 1.96 111.26 -177.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -115.11 -44.25 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.871 -0.332 . . . . 4.3899999999999997 110.461 -178.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.466 ' HA2' ' HA ' ' A' ' 152' ' ' VAL . . . 50.86 -160.17 1.61 Allowed Glycine 0 CA--C 1.509 -0.343 0 CA-C-O 121.813 0.674 . . . . 1.1000000000000001 114.597 178.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.789 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 23.9 t-20 -110.56 117.38 33.38 Favored 'General case' 0 N--CA 1.433 -1.289 0 CA-C-N 114.37 -0.915 . . . . 1.29 110.197 -177.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.668 ' HA ' ' HB1' ' A' ' 161' ' ' ALA . 19.0 m120 -93.46 -12.5 29.59 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.562 -0.29 . . . . 3.4399999999999999 110.668 -178.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -52.42 -53.92 38.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.862 -0.608 . . . . 2.6699999999999999 110.529 176.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -86.0 -34.28 20.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.124 -0.489 . . . . 2.8700000000000001 111.025 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 0.668 ' HB1' ' HA ' ' A' ' 158' ' ' ASN . . . -56.08 -60.33 3.63 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.462 -0.335 . . . . 3.2000000000000002 111.827 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -69.42 -21.82 63.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.912 0.387 . . . . 3.7200000000000002 110.901 -177.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 15.9 t -74.43 -30.17 61.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.229 0.538 . . . . 4.2000000000000002 110.011 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -86.05 -17.36 35.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.496 0.665 . . . . 6.3700000000000001 109.88 178.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -67.1 -18.46 65.32 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.89 -1.05 . . . . 5.0099999999999998 111.313 -177.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -57.24 -44.73 93.22 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 121.109 -0.567 . . . . 5.0999999999999996 113.028 -176.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -69.52 -24.12 63.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.816 0.341 . . . . 5.9400000000000004 110.823 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . 0.577 ' HA ' ' O ' ' A' ' 171' ' ' GLU . 40.2 mt-10 -75.5 -0.31 19.78 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.154 -0.475 . . . . 5.8799999999999999 111.193 -179.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.511 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 2.5 tmt_? -78.25 -33.56 49.61 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.278 -1.008 . . . . 7.7999999999999998 108.278 173.409 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -95.88 -37.89 10.51 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.506 -0.77 . . . . 7.29 110.026 178.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . 0.577 ' O ' ' HA ' ' A' ' 168' ' ' GLU . 31.6 mt-10 -105.36 103.23 12.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.727 -0.67 . . . . 6.9699999999999998 110.054 177.628 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -81.37 125.79 30.82 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.448 -0.342 . . . . 9.8100000000000005 110.523 -176.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -55.59 119.72 6.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.783 -0.644 . . . . 11.99 110.4 178.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 33.3 p-80 -132.58 95.68 3.67 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.522 0.677 . . . . 11.949999999999999 110.909 -177.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -121.77 -29.0 4.41 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.37 -0.832 . . . . 14.949999999999999 109.169 174.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . 0.45 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 0.9 OUTLIER -154.54 145.02 22.18 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.336 -0.987 . . . . 15.880000000000001 108.336 177.481 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . 0.429 ' C ' ' H ' ' A' ' 179' ' ' GLU . 33.7 m80 -64.89 -27.06 68.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.79 0.329 . . . . 16.02 110.555 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 176' ' ' HIS . 95.9 mt 74.61 -20.39 0.33 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.473 -0.785 . . . . 18.210000000000001 112.208 171.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . 0.463 ' C ' ' H ' ' A' ' 181' ' ' HIS . 33.4 tt0 65.68 -85.68 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 O-C-N 123.713 0.633 . . . . 19.219999999999999 110.602 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 24.7 t-80 70.95 -14.49 0.44 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.259 0.624 . . . . 22.800000000000001 111.941 173.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . 0.463 ' H ' ' C ' ' A' ' 179' ' ' GLU . 21.9 p-80 -152.91 156.29 38.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.392 -0.367 . . . . 22.510000000000002 110.022 179.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -65.03 150.44 48.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.167 -0.469 . . . . 25.300000000000001 111.536 -177.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 47.3 m-70 -87.5 157.9 19.07 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.854 -0.612 . . . . 25.77 109.598 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -71.6 -48.27 49.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.103 0.478 . . . . 27.370000000000001 110.137 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 66.2 m-70 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.71 -0.662 . . . . 29.52 109.697 177.558 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.156 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . 115.68 159.76 12.19 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.903 -0.665 . . . . 2.9900000000000002 111.958 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1003 ' ' CYS . . . . . . . . . . . . . 13.4 m 56.93 -141.95 0.77 Allowed 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 122.432 0.293 . . . . 1.9399999999999999 110.69 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.807 ' HA ' ' HG ' ' B' 1008 ' ' LEU . 15.7 m 37.29 -88.95 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 124.821 1.249 . . . . 1.9399999999999999 113.953 173.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 0.497 ' H ' HG22 ' B' 1004 ' ' VAL . . . -35.38 -33.21 0.04 OUTLIER Glycine 0 C--N 1.349 1.258 0 CA-C-N 118.161 0.437 . . . . 1.26 114.026 168.483 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -102.63 -48.5 4.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.951 0.405 . . . . 3.4500000000000002 111.125 174.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1007 ' ' ALA . . . . . 0.421 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -63.23 -53.88 46.06 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.913 0.709 . . . . 1.54 112.913 -169.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.847 HD13 HG11 ' A' ' 86' ' ' VAL . 3.1 mt -72.55 -40.41 66.72 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.335 -0.617 . . . . 1.8999999999999999 109.335 -171.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 1.123 ' HB1' ' HB2' ' A' ' 89' ' ' GLU . . . -47.73 -49.97 26.63 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 122.212 1.006 . . . . 1.45 109.92 169.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.855 ' HB3' ' C13' ' B' 1100 ' ' 33B . . . -69.14 -49.42 57.09 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 113.82 -1.537 . . . . 1.51 111.997 -175.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.689 ' CZ ' ' H8 ' ' B' 1100 ' ' 33B . 28.7 m-85 -68.4 -23.76 64.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.238 -0.437 . . . . 2.0699999999999998 111.161 -176.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -68.18 -23.81 74.72 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 116.062 -0.517 . . . . 0.80000000000000004 113.639 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1013 ' ' ASP . . . . . 0.42 ' C ' ' H20' ' B' 1100 ' ' 33B . 0.9 OUTLIER -69.62 -2.87 12.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.274 0.472 . . . . 1.8999999999999999 112.274 -179.454 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 32.8 m -109.59 7.71 24.68 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 111.901 0.334 . . . . 1.4399999999999999 111.901 -178.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.549 ' HB ' ' HA3' ' A' ' 98' ' ' GLY . 42.1 mt -94.36 78.4 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.984 0.421 . . . . 3.4300000000000002 111.097 -177.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -168.8 141.4 2.78 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.131 -0.692 . . . . 4.79 109.131 176.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 6.0 tpp180 -117.09 -78.17 0.58 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.822 0.344 . . . . 8.9800000000000004 110.457 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 116.721 -0.218 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.855 ' C13' ' HB3' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 mmt . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 120.423 0.154 . . . . 6.4500000000000002 110.852 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.0 m -80.56 151.41 29.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.865 0.364 . . . . 2.2599999999999998 111.151 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 -97.18 -6.27 35.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.579 0.704 . . . . 2.7599999999999998 109.707 178.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.41 ' HB3' ' OG ' ' A' ' 43' ' ' SER . 1.4 m -64.64 -26.47 68.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.071 -0.968 . . . . 1.54 112.208 -174.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.577 ' HB2' HD13 ' A' ' 134' ' ' LEU . 5.2 p30 -66.39 -28.56 68.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.674 0.274 . . . . 1.78 111.483 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.634 ' O ' HG23 ' A' ' 10' ' ' VAL . 7.2 tpp180 -56.99 -46.14 82.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.021 -0.536 . . . . 1.8999999999999999 110.113 177.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.766 ' OE1' ' HA2' ' A' ' 40' ' ' GLY . 44.1 mt-10 -55.18 -49.71 71.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.123 -0.944 . . . . 0.68000000000000005 111.367 -178.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.487 HD22 HG22 ' A' ' 46' ' ' VAL . 9.0 mt -58.7 -35.83 73.27 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.936 -1.029 . . . . 1.8 110.271 -173.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.44 HG22 ' N ' ' A' ' 131' ' ' ALA . 75.8 t -70.97 -58.94 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.558 -0.747 . . . . 1.0700000000000001 109.985 174.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.634 HG23 ' O ' ' A' ' 6' ' ' ARG . 86.5 t -52.88 -55.62 11.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.864 -1.062 . . . . 1.1299999999999999 112.243 -174.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.42 -36.35 71.24 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.142 -0.481 . . . . 0.58999999999999997 110.385 -177.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.687 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 5.7 t80 -70.45 -49.38 49.24 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.847 -0.615 . . . . 2.02 110.573 -178.49 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.972 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.0 mp -62.11 -38.64 89.66 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 120.558 -0.457 . . . . 1.0600000000000001 110.489 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.409 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 28.6 t -55.65 -46.34 77.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.883 -0.599 . . . . 1.6000000000000001 110.403 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -69.04 -29.07 67.14 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.896 -0.593 . . . . 1.49 110.85 -179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.627 ' HG2' ' O ' ' A' ' 12' ' ' PHE . 10.0 mmpt? -71.71 -37.42 70.66 Favored 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 121.057 -0.257 . . . . 1.8400000000000001 110.709 -179.06 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.463 HD21 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -66.64 -30.73 71.06 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.943 -0.391 . . . . 1.98 109.943 174.761 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.0 t -64.05 -25.55 68.16 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.978 -0.556 . . . . 1.3799999999999999 111.451 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -72.68 -18.53 61.54 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.863 0.84 . . . . 1.51 110.095 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.552 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.0 mmmt -104.83 -26.36 12.26 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.249 -1.341 . . . . 2.6499999999999999 109.281 -175.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.35 26.53 7.7 Favored Glycine 0 N--CA 1.438 -1.193 0 CA-C-N 113.815 -1.539 . . . . 0.54000000000000004 111.433 178.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.666 ' HB3' ' HE2' ' A' ' 27' ' ' PHE . 96.0 m-85 -115.46 166.82 11.46 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.335 -0.432 . . . . 1.1200000000000001 110.298 177.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.9 t -110.8 145.76 37.59 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.274 -0.421 . . . . 0.75 110.632 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.413 ' CE2' HG11 ' A' ' 10' ' ' VAL . 1.7 t90 -68.88 -49.99 53.52 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.248 -0.433 . . . . 4.29 109.897 174.42 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.8 p -61.77 -37.46 84.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.642 -0.708 . . . . 1.8600000000000001 111.45 -173.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -58.88 -28.75 66.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.209 -0.451 . . . . 1.52 111.477 178.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.666 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 17.4 m-85 -117.04 16.31 15.04 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.035 0.445 . . . . 1.53 110.726 -175.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.61 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 78.9 p -100.46 179.52 4.42 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.4 0.619 . . . . 2.04 111.814 -174.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.622 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 14.3 t70 -167.05 -13.17 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.399 -1.273 . . . . 2.3100000000000001 108.515 -178.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.598 HG22 ' H ' ' A' ' 31' ' ' GLU . 9.0 m -67.48 -72.0 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.232 -1.349 . . . . 1.4099999999999999 111.707 179.085 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.598 ' H ' HG22 ' A' ' 30' ' ' VAL . 28.4 mm-40 -94.48 2.54 55.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.846 -0.798 . . . . 2.7400000000000002 108.846 177.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.622 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 6.2 tt0 -61.17 -68.48 0.31 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.8 -1.091 . . . . 1.45 111.084 -177.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -87.16 -35.11 18.79 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.732 -0.667 . . . . 1.8700000000000001 111.268 -175.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.451 ' O ' ' HA ' ' A' ' 31' ' ' GLU . 10.0 ptt180 -112.78 139.93 47.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.893 -0.594 . . . . 3.8199999999999998 110.409 178.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 19.8 p -107.72 114.3 28.17 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.186 0.517 . . . . 2.6699999999999999 110.481 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -117.32 -60.71 1.8 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.721 -0.672 . . . . 3.3399999999999999 111.098 -175.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.444 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . . . -71.36 139.91 84.63 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.596 -0.729 . . . . 2.4399999999999999 110.967 177.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.542 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 13.1 Cg_exo -70.16 178.0 5.27 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 123.145 2.564 . . . . 1.8700000000000001 111.4 174.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -74.39 -9.78 58.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.652 0.739 . . . . 4.6399999999999997 110.216 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.766 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 151.5 66.76 0.01 OUTLIER Glycine 0 N--CA 1.439 -1.163 0 CA-C-N 115.215 -0.902 . . . . 2.3999999999999999 111.124 -178.005 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.87 HG21 ' H ' ' A' ' 42' ' ' GLU . 2.6 t -63.55 -73.64 0.11 Allowed 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 120.345 -0.542 . . . . 1.45 109.931 -174.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.87 ' H ' HG21 ' A' ' 41' ' ' THR . 14.5 pt-20 -93.32 -31.66 14.59 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.618 1.199 . . . . 2.02 108.631 166.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.893 ' HA ' HG11 ' A' ' 46' ' ' VAL . 39.4 m -68.94 -17.21 63.92 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 113.071 -1.877 . . . . 1.25 114.68 -167.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.427 ' HB2' ' HA3' ' A' ' 40' ' ' GLY . 45.1 tt0 -52.82 -39.82 62.76 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 118.439 0.563 . . . . 1.9099999999999999 111.001 -178.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -82.08 -40.38 22.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.592 -0.276 . . . . 1.1799999999999999 111.205 176.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.893 HG11 ' HA ' ' A' ' 43' ' ' SER . 1.8 m -69.43 -36.95 74.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.896 -0.321 . . . . 2.0099999999999998 111.313 -175.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -71.27 -34.94 71.15 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 108.776 -0.824 . . . . 1.3799999999999999 108.776 178.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.536 ' NE2' ' HD3' ' A' ' 51' ' ' ARG . 4.3 mm100 -64.21 -32.88 74.63 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.161 -0.927 . . . . 0.98999999999999999 110.42 177.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.615 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -77.42 -42.44 36.13 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.886 -0.597 . . . . 1.1399999999999999 110.779 175.511 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.482 HD13 ' CE2' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -66.51 -23.13 66.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.001 -0.545 . . . . 1.95 112.242 -176.387 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.536 ' HD3' ' NE2' ' A' ' 48' ' ' GLN . 16.2 ptm180 -78.12 -29.13 48.72 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 107.863 -1.162 . . . . 2.5099999999999998 107.863 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.903 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 6.6 mm-40 -74.42 -52.13 12.93 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 113.565 -1.652 . . . . 1.1000000000000001 109.835 177.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.07 -44.39 92.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.823 -0.626 . . . . 1.04 111.025 178.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.564 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.86 -36.04 92.84 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 121.045 -0.598 . . . . 0.69999999999999996 111.984 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.41 ' O ' HD11 ' A' ' 59' ' ' LEU . 22.0 t70 -64.33 -37.11 86.34 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 110.34 -0.245 . . . . 1.04 110.34 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.569 ' HA ' HD12 ' A' ' 59' ' ' LEU . 24.3 mm-40 -60.5 -27.06 67.3 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.544 0.528 . . . . 2.29 111.292 177.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.573 ' HD2' ' HB3' ' A' ' 105' ' ' SER . 36.8 t80 -80.33 -26.4 38.77 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.986 0.422 . . . . 2.9300000000000002 110.271 175.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.564 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 46.4 mt-10 -67.94 -60.78 2.24 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.933 -0.576 . . . . 1.3 111.951 -174.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.62 HD23 ' N ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -55.71 -33.76 64.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 118.18 0.445 . . . . 2.1899999999999999 110.995 -178.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.62 ' N ' HD23 ' A' ' 59' ' ' LEU . 59.7 mtt180 -60.22 -62.65 1.71 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.759 -0.655 . . . . 3.1400000000000001 112.049 172.333 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.676 ' HH ' HD22 ' A' ' 68' ' ' LEU . 6.0 t80 -92.71 -2.98 55.58 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.339 0.866 . . . . 5.5899999999999999 113.339 -168.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.856 ' HA ' ' CE2' ' A' ' 65' ' ' PHE . 32.6 ttt180 -52.81 -45.61 67.31 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.895 0.702 . . . . 4.9299999999999997 112.895 -171.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -69.56 -14.04 62.64 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.964 -0.294 . . . . 5.3499999999999996 111.212 -178.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.671 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.35 -60.77 1.84 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.012 0.375 . . . . 1.7 112.012 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.856 ' CE2' ' HA ' ' A' ' 62' ' ' ARG . 4.9 p90 -57.88 -29.45 65.04 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.751 1.019 . . . . 3.52 113.751 -167.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.3 t -90.74 -11.33 39.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.312 0.577 . . . . 2.5899999999999999 110.43 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -90.8 -50.97 5.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.779 0.8 . . . . 2.7200000000000002 110.413 -177.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 1.061 HD12 HD11 ' A' ' 72' ' ' LEU . 0.4 OUTLIER -67.44 -4.29 10.85 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.357 -1.292 . . . . 2.25 114.4 -174.372 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.723 HG21 HG13 ' A' ' 74' ' ' ILE . 3.2 p -45.78 -23.75 0.3 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 118.779 0.718 . . . . 1.26 112.86 -171.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 73.7 m -46.48 -60.15 2.53 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.1 0.56 . . . . 1.8 111.508 166.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.646 HE21 ' CB ' ' A' ' 68' ' ' LEU . 2.0 mp0 -47.79 -51.5 22.27 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 124.441 1.097 . . . . 1.8899999999999999 111.39 176.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 1.061 HD11 HD12 ' A' ' 68' ' ' LEU . 2.9 mp -77.59 -19.82 54.97 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.236 -1.347 . . . . 1.98 111.339 -166.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.9 t-80 54.54 50.0 17.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.817 0.818 . . . . 3.54 109.103 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.723 HG13 HG21 ' A' ' 69' ' ' THR . 30.9 mm -57.44 105.67 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 114.113 -1.403 . . . . 1.1499999999999999 111.33 -177.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.754 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.91 -169.55 0.22 Allowed Pre-proline 0 C--N 1.315 -0.913 0 N-CA-C 107.022 -1.473 . . . . 1.1200000000000001 107.022 -169.146 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.754 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 65.9 Cg_exo -28.92 165.38 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 124.674 3.583 . . . . 0.53000000000000003 115.236 164.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.648 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -28.72 -32.67 0.01 OUTLIER Glycine 0 N--CA 1.469 0.834 0 N-CA-C 117.523 1.769 . . . . 0.40999999999999998 117.523 -171.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.443 ' N ' ' O ' ' A' ' 76' ' ' PRO . 37.3 p -64.43 3.67 0.45 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 118.125 0.962 . . . . 1.22 112.618 -176.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.1 -14.36 62.96 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.235 0.54 . . . . 1.0700000000000001 109.608 171.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.648 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 13.3 p90 -72.66 -20.81 61.18 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.791 -0.64 . . . . 4.3099999999999996 109.44 175.115 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.535 HE21 ' HH ' ' A' ' 80' ' ' TYR . 57.0 mt-30 -79.08 -30.05 43.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.442 0.639 . . . . 1.03 109.854 177.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -70.55 -49.17 50.82 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.9 -1.045 . . . . 0.47999999999999998 109.263 173.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.413 ' O ' HG11 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -68.72 -16.69 63.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.053 -1.431 . . . . 1.4399999999999999 110.773 176.264 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.587 ' HA ' HG11 ' A' ' 87' ' ' VAL . 40.5 tt0 -70.71 -52.43 21.0 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.086 -0.507 . . . . 0.80000000000000004 110.809 178.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 81' ' ' GLN . 58.4 mt-30 -45.64 -40.53 9.16 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 114.802 -1.09 . . . . 1.99 111.207 -179.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.908 ' HA ' ' HA2' ' B' 1005 ' ' GLY . 1.2 p -86.47 -47.71 16.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-N 113.55 -1.659 . . . . 1.8999999999999999 111.697 -173.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.587 HG11 ' HA ' ' A' ' 84' ' ' GLU . 8.1 p -61.95 -24.95 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.882 0.849 . . . . 1.4299999999999999 109.835 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.438 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 0.6 OUTLIER -62.11 -44.83 95.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.266 -1.334 . . . . 0.91000000000000003 110.629 178.518 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.824 ' HB3' ' HB1' ' B' 1009 ' ' ALA . 7.9 mm-40 -71.66 -37.92 70.73 Favored 'General case' 0 CA--C 1.495 -1.164 0 CA-C-O 121.719 0.771 . . . . 2.8700000000000001 109.758 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' A' ' 87' ' ' VAL . 16.3 mt -59.78 -19.03 47.95 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 113.781 -1.554 . . . . 1.9199999999999999 111.884 -172.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.639 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 84.9 t80 -105.04 -35.58 7.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.51 0.672 . . . . 2.9700000000000002 111.489 -177.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.438 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 8.4 ptm180 -84.0 -36.41 23.18 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.863 -0.608 . . . . 5.6699999999999999 111.471 -172.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -95.85 21.21 8.83 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.901 -0.59 . . . . 3.1200000000000001 112.58 -170.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.19 68.41 0.11 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 117.665 -2.207 . . . . 2.3100000000000001 115.814 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.639 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 60.8 t -74.98 102.1 2.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 118.599 1.2 . . . . 1.6799999999999999 111.243 174.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.447 HD21 ' HB2' ' A' ' 99' ' ' ARG . 0.3 OUTLIER -111.54 -173.18 2.19 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.547 -1.206 . . . . 2.1200000000000001 108.402 173.072 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.575 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 7.5 m95 -61.98 -55.31 30.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.707 0.289 . . . . 4.1200000000000001 111.245 177.092 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.68 -15.46 71.09 Favored Glycine 0 CA--C 1.519 0.314 0 C-N-CA 120.943 -0.646 . . . . 0.80000000000000004 113.097 -178.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.562 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 20.3 tpp180 -69.82 -43.49 71.91 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.218 0.532 . . . . 4.9100000000000001 110.622 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.478 ' O ' ' HD1' ' A' ' 104' ' ' PHE . 61.2 mt -68.09 -34.98 69.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.447 -0.797 . . . . 1.1100000000000001 111.38 -175.036 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -60.74 -29.19 44.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 120.841 0.353 . . . . 2.0299999999999998 110.774 179.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.438 ' O ' ' HD1' ' A' ' 106' ' ' PHE . . . -62.55 -46.93 86.1 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.447 0.641 . . . . 1.0600000000000001 110.268 177.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.608 ' HA ' ' HE1' ' A' ' 106' ' ' PHE . 30.8 t80 -53.43 -37.71 62.82 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.356 -1.293 . . . . 1.8400000000000001 111.211 177.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.675 ' HZ ' HD11 ' A' ' 134' ' ' LEU . 47.7 m-85 -76.53 -39.47 52.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.298 -0.41 . . . . 4.21 111.116 178.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.687 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 22.6 t -63.04 -54.86 31.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.013 -0.54 . . . . 1.55 111.317 -176.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.608 ' HE1' ' HA ' ' A' ' 103' ' ' PHE . 3.9 p90 -76.81 -23.51 52.82 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.436 -0.506 . . . . 3.6400000000000001 110.41 -177.404 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.38 -44.64 73.12 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 110.8 -0.92 . . . . 0.32000000000000001 110.8 174.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.972 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.32 -31.18 79.64 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.874 -0.679 . . . . 0.23999999999999999 111.53 175.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -76.0 -28.87 57.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.787 0.327 . . . . 1.05 110.745 176.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.456 ' HB3' HD12 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.66 -41.78 98.17 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.083 -1.08 . . . . 1.78 108.083 178.366 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.625 ' SG ' HG21 ' A' ' 123' ' ' VAL . 16.9 t -49.63 -51.66 36.14 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 113.449 -1.705 . . . . 0.90000000000000002 110.964 172.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.552 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 69.1 t -65.66 -40.94 89.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.346 -0.388 . . . . 1.2 111.924 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.686 ' HB3' HG21 ' A' ' 74' ' ' ILE . 18.3 mm-40 -63.03 -22.85 67.14 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.238 0.542 . . . . 2.5099999999999998 110.499 178.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.475 ' HB3' ' HB2' ' A' ' 122' ' ' LEU . 26.4 m -76.99 -37.76 54.5 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.977 -0.749 . . . . 0.28000000000000003 108.977 174.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.578 HG23 ' O ' ' A' ' 111' ' ' CYS . 98.1 t -66.17 -35.11 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.147 -0.933 . . . . 1.8300000000000001 109.332 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.502 ' OD2' ' HD3' ' A' ' 117' ' ' LYS . 25.9 t70 -52.0 -51.22 58.76 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 113.48 -1.691 . . . . 0.59999999999999998 111.597 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.502 ' HD3' ' OD2' ' A' ' 116' ' ' ASP . 12.7 mmtp -85.38 13.78 6.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.017 -0.538 . . . . 2.1600000000000001 110.282 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.409 ' HA ' HE21 ' A' ' 120' ' ' GLN . 46.1 mt-10 61.79 44.38 8.68 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.715 0.769 . . . . 1.8799999999999999 110.53 -178.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.465 ' HB3' HD21 ' A' ' 122' ' ' LEU . 25.8 mtm -119.74 44.8 2.3 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 107.871 -1.159 . . . . 1.0800000000000001 107.871 -179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.443 ' HA ' HG23 ' A' ' 123' ' ' VAL . 3.1 mt-30 -60.4 -7.2 1.9 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.52 -1.218 . . . . 1.1499999999999999 112.845 -175.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.524 HG22 HD22 ' A' ' 122' ' ' LEU . 27.4 m -67.29 -25.14 32.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.628 0.251 . . . . 1.1899999999999999 111.205 172.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.524 HD22 HG22 ' A' ' 121' ' ' VAL . 3.5 mm? -70.93 -29.33 65.34 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 110.161 -0.311 . . . . 1.0600000000000001 110.161 177.449 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.625 HG21 ' SG ' ' A' ' 111' ' ' CYS . 72.2 t -44.79 -53.57 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 123.841 0.713 . . . . 1.0 111.78 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.61 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 0.0 OUTLIER -70.68 -37.15 73.6 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 116.057 -0.52 . . . . 1.6599999999999999 111.244 -179.565 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.503 ' HD3' HD11 ' A' ' 122' ' ' LEU . 60.8 mtp180 -62.36 -57.05 12.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 116.142 -0.481 . . . . 3.2999999999999998 110.502 -179.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.575 HG23 ' SD ' ' A' ' 130' ' ' MET . 76.7 mt -52.53 -49.82 42.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.677 -0.692 . . . . 1.0600000000000001 110.613 -178.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.6 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.96 -36.84 70.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.942 0.401 . . . . 1.1000000000000001 111.193 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.75 -60.86 2.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.336 0.589 . . . . 1.1200000000000001 110.397 176.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -60.17 -32.61 71.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.638 -1.165 . . . . 4.7699999999999996 111.227 -176.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.579 ' SD ' HD11 ' A' ' 13' ' ' LEU . 89.2 mtp -63.51 -56.43 16.11 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.954 0.407 . . . . 1.0900000000000001 110.765 177.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.44 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -61.17 -37.03 81.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.27 -0.423 . . . . 1.05 110.545 179.394 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.412 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 98.0 m -63.22 -45.12 93.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.454 -0.339 . . . . 1.1299999999999999 111.232 177.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -56.45 -40.34 74.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.176 0.512 . . . . 3.3500000000000001 109.877 177.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.964 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.2 tt -65.06 -49.67 69.17 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.313 -0.625 . . . . 1.5900000000000001 109.313 175.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . 0.412 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 4.7 m-80 -49.91 -49.12 50.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.792 -0.64 . . . . 0.46000000000000002 111.905 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -81.97 -54.54 5.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.15 -0.477 . . . . 0.58999999999999997 111.86 -176.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.76 -51.03 5.43 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.283 0.846 . . . . 2.3399999999999999 113.283 -169.012 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.964 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -79.88 -44.18 20.91 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 114.054 1.131 . . . . 1.8999999999999999 114.054 -165.006 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.647 ' HA ' HD13 ' A' ' 142' ' ' ILE . 37.0 tt0 -47.18 -51.73 39.65 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 112.69 0.626 . . . . 0.75 112.69 -174.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.556 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 51.1 Cg_exo -52.75 -50.66 13.29 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 121.962 1.774 . . . . 0.87 111.784 177.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 4.2 t-105 -58.44 -50.75 72.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.51 -0.768 . . . . 1.4299999999999999 110.441 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.647 HD13 ' HA ' ' A' ' 139' ' ' GLU . 54.7 mt -46.43 -53.87 2.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.117 -0.492 . . . . 1.1299999999999999 111.613 175.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.593 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 78.3 mm-40 -59.16 -34.15 71.76 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.689 -0.687 . . . . 0.57999999999999996 111.723 -178.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 67.8 mm-40 -63.3 -25.76 68.46 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.573 0.701 . . . . 0.78000000000000003 111.029 177.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.62 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -96.06 -16.67 21.46 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.182 -0.917 . . . . 0.93000000000000005 109.625 -171.855 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 142.62 -40.05 1.3 Allowed Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.478 -0.783 . . . . 0.56000000000000005 112.665 175.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . 0.449 ' H ' ' HH2' ' A' ' 97' ' ' TRP . . . 120.36 170.62 14.3 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.958 -0.639 . . . . 0.48999999999999999 111.675 -178.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.696 ' HZ2' HD23 ' A' ' 134' ' ' LEU . 6.8 m0 -65.92 -35.09 79.65 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.923 0.342 . . . . 4.5199999999999996 111.923 -175.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.539 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 8.8 m-20 -63.23 -31.08 72.14 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.697 0.284 . . . . 1.96 110.247 177.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.516 ' O ' HD13 ' A' ' 154' ' ' LEU . 72.3 m -70.11 -36.06 74.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.416 -0.356 . . . . 1.24 110.867 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.575 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 91.1 t80 -62.27 -33.45 74.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.787 -0.82 . . . . 3.7200000000000002 108.787 178.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.539 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 90.8 t -63.88 -52.83 51.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 114.438 -1.255 . . . . 1.8600000000000001 111.131 174.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 24.0 mm-40 -48.75 -46.99 41.97 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.125 -0.943 . . . . 1.6699999999999999 111.643 176.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.516 HD13 ' O ' ' A' ' 150' ' ' THR . 8.2 mp -78.17 -60.81 2.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.998 0.74 . . . . 1.96 112.998 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -119.85 27.48 8.67 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.187 -0.46 . . . . 4.3899999999999997 110.632 -167.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.615 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -57.62 165.44 6.44 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 115.619 -0.719 . . . . 1.1000000000000001 114.336 -179.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.903 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 29.4 t-20 -44.77 111.29 0.3 Allowed 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 113.308 -1.446 . . . . 1.29 112.107 -177.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 1.096 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 0.8 OUTLIER -76.45 -16.95 59.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.043 -0.526 . . . . 3.4399999999999999 111.481 -174.059 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . 0.404 ' HB3' ' OD1' ' A' ' 157' ' ' ASN . . . -57.42 -34.02 68.5 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.284 0.564 . . . . 2.6699999999999999 109.607 171.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.401 ' O ' ' HB3' ' A' ' 163' ' ' SER . . . -99.3 -34.98 10.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.662 -0.699 . . . . 2.8700000000000001 110.698 174.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 1.096 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -59.37 -48.49 81.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.105 -0.498 . . . . 3.2000000000000002 111.689 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.424 ' HA ' ' CB ' ' A' ' 165' ' ' LYS . 38.9 mt-10 -70.2 -15.09 62.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.632 0.253 . . . . 3.7200000000000002 111.064 -178.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.456 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 32.8 t -68.68 -40.01 80.31 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.937 -0.764 . . . . 4.2000000000000002 108.937 173.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . 0.602 ' HA ' ' HG2' ' A' ' 167' ' ' GLN . 1.8 mpp_? -78.51 -26.53 45.91 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.96 -0.564 . . . . 6.3700000000000001 110.653 175.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.424 ' CB ' ' HA ' ' A' ' 162' ' ' GLU . 40.3 ttmt -56.99 -39.15 74.12 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.829 -0.623 . . . . 5.0099999999999998 110.644 177.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -84.93 -39.98 8.34 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.89 -0.671 . . . . 5.0999999999999996 113.261 -177.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.602 ' HG2' ' HA ' ' A' ' 164' ' ' ARG . 14.7 pt20 -77.22 -41.55 40.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 117.099 0.449 . . . . 5.9400000000000004 111.591 -176.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 24.6 mm-40 -81.07 13.29 2.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.91 0.386 . . . . 5.8799999999999999 110.245 -178.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.449 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 4.3 tmt_? -58.02 -32.59 68.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.808 -0.633 . . . . 7.7999999999999998 109.853 178.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -72.83 -25.22 61.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.466 -0.788 . . . . 7.29 111.171 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -100.92 -30.47 11.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.123 -0.49 . . . . 6.9699999999999998 111.26 -176.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 57.6 m80 64.38 -169.35 0.2 Allowed 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.809 -0.632 . . . . 9.8100000000000005 109.781 -173.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 38.5 m80 61.29 32.9 19.22 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.723 0.297 . . . . 11.99 110.661 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 24.9 p80 -78.47 14.48 1.24 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.79 0.328 . . . . 11.949999999999999 111.709 -173.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -77.25 -11.49 59.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.914 -0.773 . . . . 14.949999999999999 108.914 166.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -121.27 163.13 19.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.859 -1.064 . . . . 15.880000000000001 108.343 173.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -118.27 135.01 54.54 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.125 0.488 . . . . 16.02 110.983 -178.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.611 ' H ' HD21 ' A' ' 178' ' ' LEU . 1.7 pt? -52.31 143.03 15.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.863 -1.062 . . . . 18.210000000000001 112.687 -176.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -99.97 -55.02 2.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.429 -0.805 . . . . 19.219999999999999 110.317 176.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 41.0 m170 62.49 96.62 0.04 OUTLIER 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.304 -0.862 . . . . 22.800000000000001 109.856 -170.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -79.61 66.26 5.02 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.747 -0.66 . . . . 22.510000000000002 110.641 -174.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 18.0 t60 -107.22 -37.07 6.37 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.238 -1.023 . . . . 25.300000000000001 108.238 173.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -77.34 102.61 6.85 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.143 -0.935 . . . . 25.77 109.178 171.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 21.5 p-80 -109.85 148.86 30.75 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.804 -0.635 . . . . 27.370000000000001 110.15 -176.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 . . . . . 0 C--O 1.246 0.907 0 CA-C-O 118.398 -0.81 . . . . 29.52 109.828 -179.885 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.141 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B 1002 ' ' GLY . . . . . 0.57 ' O ' ' H1 ' ' B' 1100 ' ' 33B . . . -178.63 105.32 0.2 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.729 -0.748 . . . . 2.9900000000000002 112.345 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.78 ' HB3' ' O62' ' B' 1100 ' ' 33B . 6.8 m -123.91 -146.13 0.35 Allowed 'General case' 0 C--N 1.322 -0.62 0 O-C-N 122.683 -0.304 . . . . 1.9399999999999999 110.316 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.807 HG22 ' H ' ' B' 1005 ' ' GLY . 9.4 m 50.47 -79.2 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.348 0 C-N-CA 125.085 1.354 . . . . 1.9399999999999999 113.224 178.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 0.908 ' HA2' ' HA ' ' A' ' 86' ' ' VAL . . . -47.1 -60.84 4.81 Favored Glycine 0 N--CA 1.43 -1.702 0 C-N-CA 119.911 -1.138 . . . . 1.26 110.594 171.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B 1006 ' ' ARG . . . . . 0.456 ' HD3' ' HA ' ' B' 1006 ' ' ARG . 29.4 mmt180 -56.63 -40.31 75.18 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 111.989 0.366 . . . . 3.4500000000000002 111.989 176.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -66.98 -52.39 43.35 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 120.692 0.282 . . . . 1.54 111.456 -175.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.665 ' HB2' HG21 ' A' ' 86' ' ' VAL . 3.8 mm? -75.14 -37.41 61.39 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.842 0.353 . . . . 1.8999999999999999 110.872 -174.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 0.824 ' HB1' ' HB3' ' A' ' 89' ' ' GLU . . . -45.72 -47.54 15.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.743 0.782 . . . . 1.45 110.057 165.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.874 ' HB3' ' C13' ' B' 1100 ' ' 33B . . . -75.56 -60.4 2.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.726 -1.124 . . . . 1.51 112.121 -177.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.645 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 50.2 m-85 -59.0 -33.25 70.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.945 -0.571 . . . . 2.0699999999999998 111.829 -176.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -67.2 -20.79 71.5 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.886 -0.673 . . . . 0.80000000000000004 113.417 -175.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 28.3 t70 -67.56 -20.16 65.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.868 0.334 . . . . 1.8999999999999999 111.213 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 10.6 m -81.04 0.02 37.71 Favored 'General case' 0 C--O 1.227 -0.106 0 CA-C-O 120.901 0.381 . . . . 1.4399999999999999 110.952 -175.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.487 HD12 ' CD1' ' A' ' 57' ' ' PHE . 2.9 mt -99.45 11.07 6.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.698 0.761 . . . . 3.4300000000000002 109.811 177.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 6.9 t30 -146.42 -48.15 0.2 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.668 -0.696 . . . . 4.79 110.187 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 86.7 mtm180 -116.24 -82.45 0.62 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.078 -0.51 . . . . 8.9800000000000004 109.955 177.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.532 -0.304 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.874 ' C13' ' HB3' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.2 tpp . . . . . 0 N--CA 1.477 0.88 0 CA-C-O 120.535 0.207 . . . . 6.4500000000000002 111.103 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.6 p -132.49 -32.3 1.33 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.778 0.288 . . . . 2.2599999999999998 111.778 -177.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 -86.38 1.84 49.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.643 0.735 . . . . 2.7599999999999998 110.008 -178.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.652 ' HA ' ' HB3' ' A' ' 37' ' ' ALA . 20.0 m -69.77 -15.42 63.13 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.02 -0.991 . . . . 1.54 112.351 -176.381 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.554 ' HA ' HD23 ' A' ' 8' ' ' LEU . 1.1 p30 -61.19 -18.7 59.57 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.092 -0.504 . . . . 1.78 110.848 175.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.599 ' O ' HG22 ' A' ' 10' ' ' VAL . 20.0 tpp85 -60.25 -45.5 93.04 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.861 -0.609 . . . . 1.8999999999999999 109.844 175.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.517 ' HB3' ' HZ3' ' A' ' 47' ' ' LYS . 42.6 mt-10 -59.56 -52.86 63.72 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.827 -0.624 . . . . 0.68000000000000005 111.274 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.554 HD23 ' HA ' ' A' ' 5' ' ' ASN . 2.7 mp -45.66 -37.46 5.76 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.223 -0.899 . . . . 1.8 111.47 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 70.0 t -76.81 -62.52 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.055 -0.521 . . . . 1.0700000000000001 110.659 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.599 HG22 ' O ' ' A' ' 6' ' ' ARG . 86.5 t -52.14 -49.96 37.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.373 -0.831 . . . . 1.1299999999999999 112.841 -174.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -54.07 -32.64 55.28 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.508 0.505 . . . . 0.58999999999999997 110.653 -175.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.539 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 55.7 t80 -84.12 -44.64 13.82 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.285 -0.416 . . . . 2.02 111.548 -179.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.875 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.7 mp -58.13 -40.5 81.42 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 120.024 -0.67 . . . . 1.0600000000000001 109.98 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.1 t -60.73 -40.89 94.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.99 -0.55 . . . . 1.6000000000000001 110.312 176.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -73.51 -25.39 60.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.814 -0.63 . . . . 1.49 111.309 -178.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.703 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.6 OUTLIER -78.52 -50.24 11.95 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-O 121.226 0.536 . . . . 1.8400000000000001 110.094 -174.637 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.691 HD22 ' SG ' ' A' ' 111' ' ' CYS . 13.2 mt -55.18 -29.78 58.56 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.511 -0.768 . . . . 1.98 111.277 173.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.7 t -60.81 -29.02 69.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.47 -0.787 . . . . 1.3799999999999999 111.908 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.703 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 20.8 pt20 -75.29 -16.72 60.41 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.201 0.524 . . . . 1.51 110.932 -176.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.763 ' HD2' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -100.66 -23.69 14.59 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 122.197 0.999 . . . . 2.6499999999999999 108.58 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.01 26.28 7.55 Favored Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 113.651 -1.613 . . . . 0.54000000000000004 112.468 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.466 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 86.8 m-85 -112.61 166.61 11.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.542 0.21 . . . . 1.1200000000000001 110.801 176.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.1 t -109.31 151.29 26.79 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.263 -0.426 . . . . 0.75 110.632 -178.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.664 ' CH2' ' HB2' ' A' ' 31' ' ' GLU . 3.0 t90 -75.06 -52.9 9.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.073 -0.512 . . . . 4.29 110.356 175.257 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.425 ' HB2' ' CE3' ' A' ' 24' ' ' TRP . 22.6 t -72.45 -18.55 61.68 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.227 -0.442 . . . . 1.8600000000000001 111.495 -172.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -65.53 -22.48 66.72 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.191 -0.604 . . . . 1.52 110.785 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -108.96 -33.75 6.83 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.826 -0.625 . . . . 1.53 110.863 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.6 m -101.54 143.84 31.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.71 0.767 . . . . 2.04 112.112 -177.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.464 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 15.4 t70 -108.15 -7.4 16.05 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.162 -1.381 . . . . 2.3100000000000001 109.383 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.624 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.0 m -53.61 -72.97 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 114.067 -1.424 . . . . 1.4099999999999999 112.915 -170.116 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.664 ' HB2' ' CH2' ' A' ' 24' ' ' TRP . 20.5 mm-40 -91.57 1.5 57.1 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.965 -0.754 . . . . 2.7400000000000002 108.965 178.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.464 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.1 tt0 -64.74 -44.11 91.17 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 114.834 -1.075 . . . . 1.45 110.205 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -108.07 -66.1 1.07 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.608 -0.724 . . . . 1.8700000000000001 110.728 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' A' ' 30' ' ' VAL . 11.3 ptp180 -79.53 167.56 20.59 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.342 -0.614 . . . . 3.8199999999999998 109.342 176.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 21.6 p -135.05 113.98 11.99 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.036 0.446 . . . . 2.6699999999999999 110.361 176.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -71.81 -62.41 1.43 Allowed 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.668 -0.697 . . . . 3.3399999999999999 110.22 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.652 ' HB3' ' HA ' ' A' ' 4' ' ' SER . . . -99.5 163.87 17.72 Favored Pre-proline 0 C--N 1.314 -0.939 0 CA-C-N 115.294 -0.866 . . . . 2.4399999999999999 110.514 176.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.494 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 50.1 Cg_exo -58.64 -170.69 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.211 2.607 . . . . 1.8700000000000001 112.63 171.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -79.67 10.49 3.95 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.222 0.534 . . . . 4.6399999999999997 110.4 176.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.709 ' HA2' ' OG ' ' A' ' 43' ' ' SER . . . 128.94 71.15 0.14 Allowed Glycine 0 N--CA 1.438 -1.202 0 CA-C-N 115.652 -0.703 . . . . 2.3999999999999999 111.403 -176.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.676 HG21 ' H ' ' A' ' 42' ' ' GLU . 1.3 t -74.11 -71.94 0.3 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 120.387 -0.525 . . . . 1.45 110.145 -177.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.676 ' H ' HG21 ' A' ' 41' ' ' THR . 0.0 OUTLIER -92.18 -34.98 14.09 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.551 0.691 . . . . 2.02 109.393 169.095 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.752 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 7.3 p -47.95 -39.29 18.89 Favored 'General case' 0 C--O 1.214 -0.794 0 CA-C-N 113.943 -1.481 . . . . 1.25 112.846 -171.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -39.4 -51.17 2.11 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 123.946 0.779 . . . . 1.9099999999999999 111.989 -175.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.72 -42.61 50.29 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 121.186 -0.206 . . . . 1.1799999999999999 111.414 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.718 HG11 ' HA ' ' A' ' 43' ' ' SER . 0.5 OUTLIER -68.0 -44.87 84.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 N-CA-C 111.652 0.241 . . . . 2.0099999999999998 111.652 -175.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.752 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.0 ptpt -67.35 -39.3 85.73 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.293 -0.632 . . . . 1.3799999999999999 109.293 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.46 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 5.6 mm100 -57.83 -43.83 86.07 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 115.631 -0.713 . . . . 0.98999999999999999 111.635 174.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.564 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -70.46 -34.95 73.0 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.243 0.544 . . . . 1.1399999999999999 110.42 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.433 ' HG ' ' CE1' ' A' ' 104' ' ' PHE . 4.0 tp -64.84 -28.48 69.58 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.322 -0.854 . . . . 1.95 111.695 -175.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.414 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 3.8 ptp85 -86.88 -23.04 25.37 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.271 0.558 . . . . 2.5099999999999998 110.108 -177.296 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.59 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.3 mm-40 -70.63 -47.42 60.14 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.091 -0.959 . . . . 1.1000000000000001 109.826 175.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.03 -36.47 75.09 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.736 -0.665 . . . . 1.04 109.438 171.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.632 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -57.9 -44.54 94.37 Favored Glycine 0 C--O 1.219 -0.79 0 CA-C-N 114.995 -1.002 . . . . 0.69999999999999996 112.276 178.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -52.36 -44.59 65.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.906 0.384 . . . . 1.04 111.329 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 41.6 mt-10 -67.47 -29.05 68.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.791 -0.641 . . . . 2.29 111.721 179.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.482 ' HE1' ' HA2' ' B' 1012 ' ' GLY . 13.4 m-85 -81.03 -41.96 21.85 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.973 -0.558 . . . . 2.9300000000000002 111.255 176.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.632 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.0 mt-10 -55.85 -50.02 71.73 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.189 0.519 . . . . 1.3 109.869 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.449 HD13 ' N ' ' A' ' 60' ' ' ARG . 3.8 pp -64.6 -35.05 79.73 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.232 -0.894 . . . . 2.1899999999999999 110.648 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.453 ' HB2' ' O ' ' A' ' 56' ' ' GLU . 8.6 ttt180 -70.1 -44.96 67.96 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 120.377 -0.529 . . . . 3.1400000000000001 111.203 -167.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -90.54 -3.75 57.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.294 -0.412 . . . . 5.5899999999999999 111.196 -179.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.497 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 51.2 ttp180 -50.06 -37.23 32.46 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.174 0.805 . . . . 4.9299999999999997 113.174 -171.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 -66.97 -38.79 86.74 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.985 0.422 . . . . 5.3499999999999996 110.937 -179.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.649 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.76 -42.82 9.36 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.603 0.964 . . . . 1.7 113.603 -172.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.497 ' CD1' ' HA ' ' A' ' 62' ' ' ARG . 8.1 p90 -52.69 -39.13 61.68 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.045 1.128 . . . . 3.52 114.045 -161.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.9 t -85.49 -21.74 28.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.155 0.502 . . . . 2.5899999999999999 110.066 -175.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -77.46 -31.84 54.07 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.038 -0.727 . . . . 2.7200000000000002 109.038 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 61.8 mt -63.46 -15.09 56.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.975 -1.011 . . . . 2.25 112.032 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.798 HG23 HG13 ' A' ' 74' ' ' ILE . 17.5 p -54.36 -37.06 64.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.254 0.55 . . . . 1.26 110.474 -177.158 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 67.2 m -61.71 -31.51 71.66 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.063 -0.971 . . . . 1.8 111.123 176.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.593 ' NE2' HD22 ' A' ' 68' ' ' LEU . 10.2 mt-30 -80.69 -47.69 13.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.603 -0.726 . . . . 1.8899999999999999 110.224 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.598 HD11 ' O ' ' A' ' 68' ' ' LEU . 1.1 mp -68.1 -31.81 71.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.544 -0.753 . . . . 1.98 110.444 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.439 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 50.4 m-70 68.51 64.06 0.34 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.607 0.718 . . . . 3.54 109.91 -173.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.798 HG13 HG23 ' A' ' 69' ' ' THR . 26.0 mm -65.02 108.88 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.477 -1.238 . . . . 1.1499999999999999 110.594 178.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.736 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.83 -171.49 0.27 Allowed Pre-proline 0 C--N 1.316 -0.869 0 N-CA-C 107.45 -1.315 . . . . 1.1200000000000001 107.45 -169.396 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.736 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.0 Cg_exo -30.91 166.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 124.777 3.652 . . . . 0.53000000000000003 114.766 164.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.473 ' N ' HD13 ' A' ' 122' ' ' LEU . . . -29.33 -28.87 0.01 OUTLIER Glycine 0 N--CA 1.476 1.353 0 N-CA-C 117.225 1.65 . . . . 0.40999999999999998 117.225 -173.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.46 ' N ' ' O ' ' A' ' 76' ' ' PRO . 31.2 p -68.87 3.46 1.96 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.838 0.819 . . . . 1.22 112.0 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.02 -14.51 61.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.184 0.516 . . . . 1.0700000000000001 109.675 170.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.434 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 44.0 t80 -75.54 -22.79 56.75 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.761 -0.654 . . . . 4.3099999999999996 109.372 174.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.426 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 34.0 mt-30 -82.57 -23.9 34.23 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.625 0.726 . . . . 1.03 109.865 174.093 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 13.7 m -72.68 -53.76 10.86 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 114.557 -1.201 . . . . 0.47999999999999998 109.565 171.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.542 ' HA ' HG22 ' A' ' 86' ' ' VAL . 85.3 t80 -65.79 -17.92 64.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.029 -0.987 . . . . 1.4399999999999999 110.229 175.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.59 ' HA ' HG12 ' A' ' 87' ' ' VAL . 34.7 tt0 -60.9 -49.34 77.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.884 -0.598 . . . . 0.80000000000000004 110.389 177.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -50.6 -34.31 25.42 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.988 -1.006 . . . . 1.99 110.622 176.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.589 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 1.8 t -80.63 -51.54 15.64 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 114.646 -1.161 . . . . 1.8999999999999999 110.602 -176.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.59 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.0 p -63.54 -21.75 29.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.826 0.822 . . . . 1.4299999999999999 109.841 -179.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.469 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.2 m-80 -78.53 -45.49 21.76 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.367 -1.288 . . . . 0.91000000000000003 111.615 175.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 1.033 ' HB2' ' HB3' ' B' 1009 ' ' ALA . 16.2 pt-20 -69.57 -32.3 70.98 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 107.961 -1.125 . . . . 2.8700000000000001 107.961 -178.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' A' ' 86' ' ' VAL . 0.2 OUTLIER -60.61 -31.06 70.25 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 113.182 -1.827 . . . . 1.9199999999999999 111.152 177.983 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.678 ' HA ' HG23 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -99.27 -38.29 8.93 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.07 0.462 . . . . 2.9700000000000002 111.29 -169.533 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.532 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 10.3 ptm180 -72.65 -34.22 67.11 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.652 -0.704 . . . . 5.6699999999999999 110.586 -174.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -89.13 8.63 29.02 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.851 -1.068 . . . . 3.1200000000000001 112.31 -172.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.68 72.52 0.11 Allowed Glycine 0 C--N 1.337 0.618 0 C-N-CA 117.01 -2.519 . . . . 2.3100000000000001 116.15 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.799 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 48.8 t -71.1 92.62 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 CA-C-N 119.053 1.427 . . . . 1.6799999999999999 111.361 177.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.434 ' ND2' ' N ' ' A' ' 96' ' ' ASN . 1.1 m120 -114.65 -170.81 1.81 Allowed 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.493 -1.23 . . . . 2.1200000000000001 108.854 178.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.831 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 13.4 m-90 -58.84 -38.0 77.72 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.064 0.459 . . . . 4.1200000000000001 110.865 177.484 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.921 ' HA3' HG22 ' B' 1015 ' ' ILE . . . -83.47 -32.19 25.66 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.91 -0.662 . . . . 0.80000000000000004 114.536 -170.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.799 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 0.6 OUTLIER -69.1 -30.08 68.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 118.078 0.939 . . . . 4.9100000000000001 109.587 -176.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 82.2 mt -69.81 -34.19 59.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.4 0.619 . . . . 1.1100000000000001 109.53 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.55 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 79.5 t -55.03 -58.66 3.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 114.935 -1.029 . . . . 2.0299999999999998 110.045 168.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -51.39 -41.74 60.92 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.773 -0.649 . . . . 1.0600000000000001 110.873 176.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -59.78 -54.3 47.9 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.441 -0.799 . . . . 1.8400000000000001 112.02 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.494 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.4 OUTLIER -72.76 -23.53 60.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.035 0.445 . . . . 4.21 110.435 -176.44 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.539 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 13.3 t -76.32 -53.88 7.57 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.794 -0.639 . . . . 1.55 110.521 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -66.9 -28.07 68.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.009 0.433 . . . . 3.6400000000000001 109.911 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.485 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -65.72 -44.09 93.0 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.79 -0.641 . . . . 0.32000000000000001 111.71 174.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.875 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.79 -35.27 91.8 Favored Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.461 -0.876 . . . . 0.23999999999999999 111.222 175.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.73 -28.91 65.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.556 -0.322 . . . . 1.05 110.81 177.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.409 ' HB3' HD12 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.24 -39.62 95.12 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.171 -1.048 . . . . 1.78 108.171 179.407 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.739 ' HG ' HG11 ' A' ' 123' ' ' VAL . 42.1 t -55.24 -53.04 61.12 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 113.989 -1.46 . . . . 0.90000000000000002 110.735 174.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.763 HG13 ' HD2' ' A' ' 20' ' ' LYS . 65.9 t -63.14 -39.6 85.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.403 -0.362 . . . . 1.2 111.852 -177.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.438 ' HB3' HG23 ' A' ' 74' ' ' ILE . 2.5 mm-40 -65.57 -22.89 66.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.058 0.456 . . . . 2.5099999999999998 110.917 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 49.1 m -79.28 -41.34 28.32 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.903 -0.777 . . . . 0.28000000000000003 108.903 175.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.591 HG22 ' CD2' ' A' ' 17' ' ' LEU . 98.0 t -65.42 -32.94 60.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 114.999 -1.0 . . . . 1.8300000000000001 109.293 179.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.36 -50.55 59.3 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 113.313 -1.767 . . . . 0.59999999999999998 111.411 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.422 ' CG ' ' HE2' ' A' ' 119' ' ' MET . 10.9 mmtp -87.03 11.07 14.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.829 -0.623 . . . . 2.1600000000000001 110.441 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.477 ' HA ' HE21 ' A' ' 120' ' ' GLN . 39.7 mt-10 66.03 43.56 2.92 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-O 121.662 0.744 . . . . 1.8799999999999999 110.227 -178.075 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.437 ' HE1' ' HB2' ' A' ' 119' ' ' MET . 26.6 mtm -118.22 48.42 1.42 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.073 -1.084 . . . . 1.0800000000000001 108.073 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.477 HE21 ' HA ' ' A' ' 118' ' ' GLU . 2.4 mt-30 -63.73 -7.27 7.18 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.641 -1.163 . . . . 1.1499999999999999 112.529 -175.092 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.506 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 34.2 m -65.19 -27.2 41.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 120.708 0.29 . . . . 1.1899999999999999 110.918 174.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.705 HD11 ' HD2' ' A' ' 125' ' ' ARG . 2.9 mm? -72.48 -27.33 62.22 Favored 'General case' 0 CA--C 1.51 -0.562 0 CA-C-N 116.589 -0.278 . . . . 1.0600000000000001 110.684 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.739 HG11 ' HG ' ' A' ' 111' ' ' CYS . 70.3 t -44.22 -53.44 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 O-C-N 123.8 0.687 . . . . 1.0 111.938 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.2 -35.69 66.4 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.756 -0.656 . . . . 1.6599999999999999 111.393 -178.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.705 ' HD2' HD11 ' A' ' 122' ' ' LEU . 70.8 mtt180 -64.78 -52.53 56.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.827 -0.624 . . . . 3.2999999999999998 110.344 -178.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.583 HG21 ' SD ' ' A' ' 130' ' ' MET . 73.1 mt -54.11 -51.89 42.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.605 -0.725 . . . . 1.0600000000000001 110.785 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.675 ' HB1' HD21 ' A' ' 13' ' ' LEU . . . -57.46 -36.34 71.3 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.713 0.292 . . . . 1.1000000000000001 111.417 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.27 -58.8 6.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.288 0.566 . . . . 1.1200000000000001 110.67 177.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.403 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 99.2 m95 -64.24 -33.71 76.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.021 -0.99 . . . . 4.7699999999999996 111.49 -176.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.583 ' SD ' HG21 ' A' ' 126' ' ' ILE . 88.8 mtp -61.96 -54.59 39.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.04 0.448 . . . . 1.0900000000000001 110.75 178.333 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.89 94.8 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.798 -0.637 . . . . 1.05 111.086 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 92.0 m -62.75 -43.9 97.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.875 0.369 . . . . 1.1299999999999999 110.776 178.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.577 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 71.8 t80 -56.34 -42.85 78.39 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.226 -0.443 . . . . 3.3500000000000001 110.032 176.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.912 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 4.9 tt -63.36 -48.01 79.72 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.102 -0.703 . . . . 1.5900000000000001 109.102 175.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -49.83 -55.67 13.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.895 -0.593 . . . . 0.46000000000000002 112.59 178.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -83.49 -47.2 11.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.064 0.459 . . . . 0.58999999999999997 111.82 -173.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . 0.577 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 44.3 m-70 -90.92 -51.36 5.39 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 112.756 0.65 . . . . 2.3399999999999999 112.756 -170.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.912 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -83.23 -46.59 12.49 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 114.515 1.302 . . . . 1.8999999999999999 114.515 -165.072 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.641 ' HA ' HD11 ' A' ' 142' ' ' ILE . 28.3 tt0 -44.98 -52.42 19.4 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.432 0.53 . . . . 0.75 112.432 -173.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.6 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.3 Cg_exo -53.38 -53.52 6.49 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.654 1.57 . . . . 0.87 111.715 176.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -55.0 -51.11 67.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.583 -0.735 . . . . 1.4299999999999999 110.347 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.641 HD11 ' HA ' ' A' ' 139' ' ' GLU . 73.6 mt -46.83 -53.89 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.823 -0.626 . . . . 1.1299999999999999 111.805 174.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.59 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 77.3 mm-40 -61.95 -29.87 70.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.896 -0.593 . . . . 0.57999999999999996 111.725 -178.656 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.6 mm-40 -64.81 -20.77 66.57 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.78 0.8 . . . . 0.78000000000000003 109.898 175.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.646 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -104.23 2.26 31.46 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.89 -1.05 . . . . 0.93000000000000005 108.783 -176.652 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 127.1 -54.39 0.77 Allowed Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 114.668 -1.151 . . . . 0.56000000000000005 112.011 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . 0.443 ' HA2' HG23 ' A' ' 142' ' ' ILE . . . 137.41 -177.75 19.59 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.922 -0.656 . . . . 0.48999999999999999 111.784 -177.439 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 11.8 m0 -68.02 -45.63 73.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.179 0.514 . . . . 4.5199999999999996 110.084 -179.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -63.72 -34.57 78.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.458 -0.792 . . . . 1.96 111.123 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.581 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 66.0 m -66.77 -30.66 70.92 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.493 -0.322 . . . . 1.24 111.702 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.831 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 86.8 t80 -59.14 -38.54 79.95 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.339 -0.544 . . . . 3.7200000000000002 109.84 174.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.539 HG12 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -75.83 -25.73 17.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.261 -0.427 . . . . 1.8600000000000001 110.19 177.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.565 ' CG ' ' HA ' ' A' ' 150' ' ' THR . 55.1 mt-10 -55.52 -31.0 61.71 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-O 121.216 0.531 . . . . 1.6699999999999999 109.835 172.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.581 ' HG ' ' O ' ' A' ' 150' ' ' THR . 0.6 OUTLIER -101.92 -50.67 3.61 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.397 -0.819 . . . . 1.96 110.984 -176.664 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . 0.446 ' CD2' ' HB2' ' A' ' 154' ' ' LEU . 97.9 m-85 -120.69 26.08 9.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.789 -0.641 . . . . 4.3899999999999997 111.653 -170.073 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.564 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -60.22 164.12 15.21 Favored Glycine 0 C--N 1.317 -0.506 0 CA-C-O 121.733 0.629 . . . . 1.1000000000000001 113.685 -176.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.59 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 29.3 t-20 -53.25 128.06 26.74 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 113.835 -1.182 . . . . 1.29 112.212 -176.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.563 ' HA ' ' HB1' ' A' ' 161' ' ' ALA . 6.0 t-20 -66.46 -31.13 71.67 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.924 -0.58 . . . . 3.4399999999999999 111.859 -173.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . 0.434 ' HB3' ' OD1' ' A' ' 157' ' ' ASN . . . -59.59 -30.19 68.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.214 0.531 . . . . 2.6699999999999999 110.463 176.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -85.44 -40.07 16.82 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.03 -0.532 . . . . 2.8700000000000001 110.029 174.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 0.563 ' HB1' ' HA ' ' A' ' 158' ' ' ASN . . . -58.61 -47.82 83.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.827 -0.624 . . . . 3.2000000000000002 111.126 178.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.465 ' HA ' ' HB3' ' A' ' 165' ' ' LYS . 28.3 mt-10 -69.08 -24.42 64.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.875 -0.602 . . . . 3.7200000000000002 111.227 179.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 33.2 t -68.0 -34.74 77.09 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.362 -0.607 . . . . 4.2000000000000002 109.362 175.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 27.0 mmm180 -85.48 -6.23 59.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.377 -0.829 . . . . 6.3700000000000001 110.32 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.465 ' HB3' ' HA ' ' A' ' 162' ' ' GLU . 35.2 ttpt -99.03 -60.83 1.46 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.264 -0.88 . . . . 5.0099999999999998 110.511 -178.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -69.72 -9.39 62.2 Favored Glycine 0 N--CA 1.444 -0.828 0 CA-C-N 114.867 -1.06 . . . . 5.0999999999999996 113.403 -173.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -55.54 -17.09 4.72 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.88 0.371 . . . . 5.9400000000000004 111.973 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . 0.856 ' HG3' ' HA ' ' A' ' 172' ' ' HIS . 33.8 tt0 -68.53 -6.12 23.48 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.358 0.599 . . . . 5.8799999999999999 110.874 176.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.541 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 0.3 OUTLIER -59.75 -32.87 70.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.831 -0.622 . . . . 7.7999999999999998 110.362 174.831 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -75.05 -44.12 49.48 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.937 0.399 . . . . 7.29 110.201 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -169.61 159.91 8.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.549 -0.75 . . . . 6.9699999999999998 109.196 177.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . 0.856 ' HA ' ' HG3' ' A' ' 168' ' ' GLU . 36.6 m80 -69.98 152.26 44.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.732 -0.213 . . . . 9.8100000000000005 110.622 -176.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -64.02 103.18 0.57 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.335 0.588 . . . . 11.99 109.648 176.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 38.5 m80 60.14 -166.52 0.19 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.422 -0.808 . . . . 11.949999999999999 110.042 -171.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 31.3 m170 66.1 21.82 11.16 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.148 0.499 . . . . 14.949999999999999 110.713 178.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -72.52 -33.66 67.04 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.104 -0.702 . . . . 15.880000000000001 109.104 177.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 66.1 m-70 -109.71 131.7 54.82 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.612 -0.722 . . . . 16.02 110.482 178.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.483 HD23 ' H ' ' A' ' 178' ' ' LEU . 1.8 pt? -117.17 16.9 14.9 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.369 -0.604 . . . . 18.210000000000001 109.369 174.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -65.8 100.01 0.51 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.109 -0.951 . . . . 19.219999999999999 110.681 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -109.2 -34.75 6.48 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.792 -0.64 . . . . 22.800000000000001 110.019 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -76.13 150.57 37.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.074 -0.512 . . . . 22.510000000000002 110.39 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -95.1 109.8 21.81 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.365 -0.605 . . . . 25.300000000000001 109.365 172.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . 0.501 ' CE1' ' HB3' ' A' ' 185' ' ' HIS . 46.6 t-80 -70.52 112.77 7.04 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.772 -0.649 . . . . 25.77 110.415 -178.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -103.29 79.3 1.7 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.082 -0.508 . . . . 27.370000000000001 110.22 -177.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . 0.501 ' HB3' ' CE1' ' A' ' 183' ' ' HIS . 52.8 t60 . . . . . 0 C--O 1.244 0.792 0 CA-C-N 115.8 -0.636 . . . . 29.52 109.48 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.239 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -74.1 -34.23 55.73 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.881 -0.676 . . . . 2.9900000000000002 112.366 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.578 ' O ' HG23 ' B' 1004 ' ' VAL . 57.3 m -136.51 -161.7 1.19 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.688 0.28 . . . . 1.9399999999999999 110.264 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.596 ' O ' ' HD3' ' B' 1006 ' ' ARG . 1.0 OUTLIER 59.93 162.31 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 125.367 1.467 . . . . 1.9399999999999999 111.434 176.584 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 0.855 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . 56.87 3.93 0.85 Allowed Glycine 0 CA--C 1.539 1.577 0 C-N-CA 120.218 -0.992 . . . . 1.26 111.902 -155.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B 1006 ' ' ARG . . . . . 0.596 ' HD3' ' O ' ' B' 1004 ' ' VAL . 6.4 mpt_? -133.14 -61.27 0.83 Allowed 'General case' 0 C--O 1.227 -0.111 0 C-N-CA 124.325 1.05 . . . . 3.4500000000000002 110.387 -177.003 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B 1007 ' ' ALA . . . . . 0.598 ' HB1' ' O2 ' ' B' 1100 ' ' 33B . . . -70.32 -49.44 49.4 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.14 -0.936 . . . . 1.54 112.593 -169.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.575 ' HB2' ' CD ' ' A' ' 89' ' ' GLU . 2.8 mm? -66.53 -39.82 88.8 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.084 -0.71 . . . . 1.8999999999999999 109.084 -176.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 1.033 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . . . -52.19 -57.46 9.59 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.51 -1.223 . . . . 1.45 110.44 171.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.811 ' HB2' ' C13' ' B' 1100 ' ' 33B . . . -69.22 -38.05 78.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 113.905 -1.498 . . . . 1.51 112.276 -172.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.65 ' CE1' ' H14' ' B' 1100 ' ' 33B . 3.9 m-30 -74.77 -24.57 58.71 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.236 -0.438 . . . . 2.0699999999999998 111.084 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B 1012 ' ' GLY . . . . . 0.482 ' HA2' ' HE1' ' A' ' 57' ' ' PHE . . . -76.95 -9.84 86.5 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 121.151 -0.547 . . . . 0.80000000000000004 112.937 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.08 -23.66 66.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.962 0.411 . . . . 1.8999999999999999 111.241 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1014 ' ' CYS . . . . . 0.421 ' N ' ' C20' ' B' 1100 ' ' 33B . 69.8 m -93.62 94.6 8.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.838 0.351 . . . . 1.4399999999999999 110.961 -175.146 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.921 HG22 ' HA3' ' A' ' 98' ' ' GLY . 22.4 pt -107.49 9.95 9.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.175 -0.466 . . . . 3.4300000000000002 110.987 178.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 17.7 m120 -114.0 -54.59 2.58 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.847 -0.615 . . . . 4.79 109.385 174.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 24.6 ptt180 -127.19 86.1 2.45 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.333 0.587 . . . . 8.9800000000000004 110.278 177.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.53 0 CA-C-N 116.187 -0.46 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.811 ' C13' ' HB2' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.505 ' HB2' ' OE2' ' A' ' 139' ' ' GLU . 61.8 mtm . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 120.963 0.411 . . . . 6.4500000000000002 110.084 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.415 ' H ' ' CD ' ' A' ' 139' ' ' GLU . 8.5 m -96.66 129.08 44.12 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.102 -0.703 . . . . 2.2599999999999998 109.102 175.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -86.9 2.27 49.77 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.366 -0.533 . . . . 2.7599999999999998 111.77 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.501 ' HB3' ' OE2' ' A' ' 42' ' ' GLU . 4.8 m -67.6 -30.41 69.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.399 -0.364 . . . . 1.54 110.732 176.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.476 ' ND2' HD21 ' A' ' 134' ' ' LEU . 0.0 OUTLIER -62.3 -15.31 47.05 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.158 0.504 . . . . 1.78 110.109 -178.436 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.678 HH12 ' HA ' ' A' ' 128' ' ' ALA . 24.6 tpp180 -52.99 -49.94 65.16 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.368 -0.833 . . . . 1.8999999999999999 110.743 174.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.607 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 42.8 mt-10 -52.6 -52.01 57.22 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.366 -1.288 . . . . 0.68000000000000005 111.873 -174.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.512 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -46.42 -45.96 18.34 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.163 -0.926 . . . . 1.8 110.788 177.656 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.629 HG13 ' HE3' ' A' ' 130' ' ' MET . 70.9 t -68.59 -61.36 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-O 121.253 0.549 . . . . 1.0700000000000001 110.187 178.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 6' ' ' ARG . 63.3 t -51.65 -52.47 21.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 114.917 -1.038 . . . . 1.1299999999999999 112.66 -173.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -58.98 -35.31 72.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.065 -0.516 . . . . 0.58999999999999997 111.105 -176.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.683 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 26.9 t80 -77.35 -38.67 49.79 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 120.561 -0.456 . . . . 2.02 111.178 -176.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.796 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.3 mp -59.4 -38.78 81.46 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 119.825 -0.75 . . . . 1.0600000000000001 109.499 175.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.423 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 40.6 t -60.8 -45.67 93.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.369 0.604 . . . . 1.6000000000000001 110.581 175.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -62.08 -32.56 73.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.275 -0.875 . . . . 1.49 111.037 -178.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.638 ' HA ' ' CE ' ' A' ' 16' ' ' LYS . 4.4 mmpt? -72.46 -43.94 63.02 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 113.102 0.778 . . . . 1.8400000000000001 113.102 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.651 HD23 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -64.39 -24.17 67.54 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.76 -0.376 . . . . 1.98 111.159 -178.376 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.0 t -58.09 -45.12 87.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.47 . . . . 1.3799999999999999 111.554 -178.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -76.87 0.26 21.51 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.05 0.452 . . . . 1.51 111.834 -177.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.0 mmmt -109.98 -28.19 8.85 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.816 0.817 . . . . 2.6499999999999999 109.313 -178.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.82 23.26 9.43 Favored Glycine 0 N--CA 1.442 -0.905 0 CA-C-N 114.087 -1.415 . . . . 0.54000000000000004 111.303 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -116.16 166.78 11.64 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.234 -0.483 . . . . 1.1200000000000001 110.395 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.433 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 5.6 t -110.27 147.61 33.52 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.11 -0.496 . . . . 0.75 110.048 179.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.423 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -77.35 -47.3 20.28 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.088 -0.505 . . . . 4.29 110.192 177.177 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.5 m -62.16 -36.13 80.92 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.773 0.286 . . . . 1.8600000000000001 111.773 -178.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.433 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 96.6 mt-30 -55.0 -28.0 48.53 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.864 0.364 . . . . 1.52 111.908 -178.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.46 ' O ' ' HB2' ' A' ' 124' ' ' SER . 35.9 m-85 -116.6 -14.93 10.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.353 -0.385 . . . . 1.53 111.512 -175.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.575 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 50.8 m -101.37 153.56 19.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.727 0.775 . . . . 2.04 112.581 -176.179 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.4 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.2 t70 -125.8 -10.92 6.68 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.116 -1.402 . . . . 2.3100000000000001 109.766 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.658 HG22 ' H ' ' A' ' 31' ' ' GLU . 4.2 m -46.97 -71.26 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.926 -1.488 . . . . 1.4099999999999999 113.1 -166.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.658 ' H ' HG22 ' A' ' 30' ' ' VAL . 8.1 pt-20 -99.32 1.82 44.85 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.203 -0.666 . . . . 2.7400000000000002 109.203 177.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.4 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.7 tt0 -66.64 -52.91 39.78 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.078 -0.964 . . . . 1.45 111.457 -175.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -103.04 -3.34 26.11 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.488 0.551 . . . . 1.8700000000000001 112.488 -171.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 34' ' ' ARG . 18.4 ptt-85 -155.6 151.14 27.17 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.936 0.398 . . . . 3.8199999999999998 111.182 175.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.6 p -132.32 106.09 7.7 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.467 0.651 . . . . 2.6699999999999999 111.328 179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.681 ' HG3' ' H ' ' A' ' 37' ' ' ALA . 12.2 pt-20 -95.64 -65.7 0.96 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.396 -0.82 . . . . 3.3399999999999999 110.35 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.681 ' H ' ' HG3' ' A' ' 36' ' ' GLU . . . -64.61 155.21 82.49 Favored Pre-proline 0 C--N 1.309 -1.179 0 CA-C-N 114.607 -1.178 . . . . 2.4399999999999999 110.467 172.179 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.499 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 32.3 Cg_exo -60.03 178.43 0.4 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.111 2.541 . . . . 1.8700000000000001 112.708 176.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.72 -0.21 14.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.352 0.596 . . . . 4.6399999999999997 110.406 179.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.513 ' HA3' ' HB2' ' A' ' 44' ' ' GLU . . . 143.78 70.02 0.02 OUTLIER Glycine 0 N--CA 1.439 -1.123 0 N-CA-C 110.988 -0.845 . . . . 2.3999999999999999 110.988 179.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.612 HG21 ' H ' ' A' ' 42' ' ' GLU . 0.3 OUTLIER -66.14 -71.98 0.18 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 120.711 -0.395 . . . . 1.45 110.035 -176.869 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.612 ' H ' HG21 ' A' ' 41' ' ' THR . 0.0 OUTLIER -91.62 -36.74 13.48 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 122.017 0.913 . . . . 2.02 109.515 171.209 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.782 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 75.0 m -69.07 -23.92 64.09 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 113.772 -1.558 . . . . 1.25 114.595 -165.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.513 ' HB2' ' HA3' ' A' ' 40' ' ' GLY . 33.9 tt0 -56.95 -44.31 82.41 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 119.889 -0.724 . . . . 1.9099999999999999 110.159 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.511 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -75.64 -39.71 57.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.017 0.436 . . . . 1.1799999999999999 110.335 175.26 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.782 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 60.1 t -54.94 -60.38 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.508 -0.769 . . . . 2.0099999999999998 111.671 178.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.607 ' NZ ' ' HB3' ' A' ' 7' ' ' GLU . 15.1 ptpt -60.07 -34.94 74.12 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.273 -0.64 . . . . 1.3799999999999999 109.273 -178.28 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.566 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 4.7 mm100 -66.6 -32.47 73.83 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.763 -0.653 . . . . 0.98999999999999999 111.054 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.668 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -81.48 -35.67 30.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.351 0.596 . . . . 1.1399999999999999 110.315 176.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.711 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.5 mp -66.56 -22.92 66.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.49 -0.777 . . . . 1.95 111.996 -177.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.566 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.3 ptp180 -86.18 -27.94 24.23 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.106 -0.702 . . . . 2.5099999999999998 109.106 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.718 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.1 mm-40 -70.12 -47.93 59.66 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.653 -1.158 . . . . 1.1000000000000001 109.524 174.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.411 ' HB1' ' HD2' ' A' ' 155' ' ' TYR . . . -68.02 -38.88 83.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.447 -0.797 . . . . 1.04 110.268 174.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.671 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -61.84 -42.78 99.78 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.51 -0.768 . . . . 0.69999999999999996 112.489 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -54.08 -44.6 71.29 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.883 0.373 . . . . 1.04 111.04 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.402 ' HA ' ' CD2' ' A' ' 59' ' ' LEU . 37.3 mt-10 -63.38 -29.22 70.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.934 -0.575 . . . . 2.29 111.388 178.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.497 ' HZ ' HD11 ' B' 1008 ' ' LEU . 71.3 t80 -77.5 -39.87 44.82 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.207 -0.451 . . . . 2.9300000000000002 110.294 177.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.671 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.4 mt-10 -62.81 -46.89 85.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.868 -0.605 . . . . 1.3 111.067 -176.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.507 HD13 ' N ' ' A' ' 60' ' ' ARG . 4.5 pp -59.25 -33.08 70.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.215 -0.448 . . . . 2.1899999999999999 112.028 -175.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.507 ' N ' HD13 ' A' ' 59' ' ' LEU . 5.7 ptp85 -87.34 -35.38 18.42 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.332 -0.547 . . . . 3.1400000000000001 112.353 -174.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.535 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 0.9 OUTLIER -91.63 -5.71 53.42 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 120.732 -0.387 . . . . 5.5899999999999999 111.299 -178.436 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 58' ' ' GLU . 69.2 ttt180 -55.86 -32.5 63.7 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.285 -0.416 . . . . 4.9299999999999997 111.644 -174.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -54.34 -39.35 67.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.837 -0.62 . . . . 5.3499999999999996 111.96 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.402 ' O ' HD11 ' A' ' 68' ' ' LEU . . . -90.72 -28.83 18.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.549 -0.296 . . . . 1.7 111.736 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.663 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 28.0 t80 -51.82 -38.55 56.24 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.86 0.689 . . . . 3.52 112.86 -172.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.1 p -72.03 -34.83 69.11 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.859 0.318 . . . . 2.5899999999999999 111.859 -176.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -90.43 -32.21 16.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.914 0.388 . . . . 2.7200000000000002 111.226 -175.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.444 ' HA ' ' HG3' ' A' ' 71' ' ' GLN . 3.6 mp -60.51 -17.35 44.98 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 112.864 0.69 . . . . 2.25 112.864 -175.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.534 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 3.0 p -58.9 -35.73 73.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 118.794 0.725 . . . . 1.26 110.403 -178.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.1 m -65.93 -28.59 69.04 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.192 -0.913 . . . . 1.8 110.437 175.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.444 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 7.6 mt-30 -86.9 -36.16 18.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.341 -0.845 . . . . 1.8899999999999999 110.249 -177.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.534 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.4 mm? -65.39 -32.53 74.2 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 109.077 -0.712 . . . . 1.98 109.077 169.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.466 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 32.7 m80 66.11 39.01 4.49 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.292 -1.003 . . . . 3.54 108.292 -173.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.534 HG12 ' HB2' ' A' ' 72' ' ' LEU . 29.0 mm -45.18 117.34 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 113.634 -1.621 . . . . 1.1499999999999999 112.316 -177.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.763 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.7 -171.34 0.27 Allowed Pre-proline 0 N--CA 1.442 -0.872 0 CA-C-N 114.574 -1.194 . . . . 1.1200000000000001 108.019 -171.078 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.763 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 52.7 Cg_exo -28.62 166.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.364 1.35 0 C-N-CA 125.299 3.999 . . . . 0.53000000000000003 115.628 165.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.46 -30.34 0.01 OUTLIER Glycine 0 N--CA 1.47 0.962 0 N-CA-C 117.449 1.74 . . . . 0.40999999999999998 117.449 -172.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.447 ' HA ' ' CD1' ' A' ' 80' ' ' TYR . 28.2 p -67.07 6.4 0.54 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.942 0.871 . . . . 1.22 112.576 -178.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.01 -10.4 57.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.327 0.584 . . . . 1.0700000000000001 110.138 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.447 ' CD1' ' HA ' ' A' ' 78' ' ' THR . 4.9 p90 -73.97 -19.1 60.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.761 -0.654 . . . . 4.3099999999999996 109.835 175.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.576 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 25.9 mt-30 -87.48 -18.27 30.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.763 0.792 . . . . 1.03 110.288 174.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.1 m -75.88 -53.42 8.46 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.663 -1.153 . . . . 0.47999999999999998 108.844 170.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.445 ' CD2' ' HZ3' ' A' ' 129' ' ' TRP . 90.2 t80 -65.66 -15.39 62.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.85 -1.068 . . . . 1.4399999999999999 110.06 174.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.629 ' HA ' HG13 ' A' ' 87' ' ' VAL . 28.7 tt0 -60.78 -49.08 78.91 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 121.773 0.797 . . . . 0.80000000000000004 110.111 176.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.404 ' H ' ' HG2' ' A' ' 85' ' ' GLN . 62.8 mm-40 -50.16 -37.58 35.37 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.731 -1.577 . . . . 1.99 112.0 -176.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.567 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 3.6 p -91.62 -42.45 13.67 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 114.633 -1.167 . . . . 1.8999999999999999 111.799 -176.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.629 HG13 ' HA ' ' A' ' 84' ' ' GLU . 9.9 p -59.71 -24.07 28.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 122.077 0.941 . . . . 1.4299999999999999 109.399 176.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.3 m-80 -71.51 -39.78 70.58 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.037 -1.438 . . . . 0.91000000000000003 111.691 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.736 ' HA ' ' HD2' ' A' ' 92' ' ' ARG . 1.6 pp20? -77.9 -32.44 51.76 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.53 0.681 . . . . 2.8700000000000001 109.653 -179.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.608 HD11 HH11 ' A' ' 99' ' ' ARG . 0.2 OUTLIER -61.71 -30.97 71.11 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.214 -1.357 . . . . 1.9199999999999999 112.008 -165.912 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -107.41 -30.06 8.89 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.208 0.447 . . . . 2.9700000000000002 112.208 -175.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.736 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -65.27 -22.05 66.8 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.066 0.46 . . . . 5.6699999999999999 111.901 -169.306 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.507 ' N ' ' HD3' ' A' ' 92' ' ' ARG . 28.1 t70 -92.91 -13.86 28.36 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.795 -0.638 . . . . 3.1200000000000001 111.67 -172.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.16 69.78 0.11 Allowed Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 118.862 -1.637 . . . . 2.3100000000000001 112.805 -173.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.551 HG11 ' CD1' ' A' ' 141' ' ' TRP . 0.1 OUTLIER -67.77 109.81 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 122.992 1.377 . . . . 1.6799999999999999 110.499 -173.576 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -108.04 -170.89 1.76 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 113.391 -1.731 . . . . 2.1200000000000001 109.653 179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.954 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 15.8 m-90 -54.9 -42.64 72.41 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.571 -0.74 . . . . 4.1200000000000001 110.664 177.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -77.27 -30.32 54.71 Favored Glycine 0 N--CA 1.452 -0.282 0 CA-C-N 115.909 -0.587 . . . . 0.80000000000000004 113.567 -174.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.735 HH12 ' HA ' ' B' 1009 ' ' ALA . 16.5 mmt180 -59.97 -36.61 77.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.314 0.578 . . . . 4.9100000000000001 111.368 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.474 HG12 ' HG ' ' A' ' 138' ' ' LEU . 94.5 mt -78.0 -32.35 17.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.601 -0.727 . . . . 1.1100000000000001 111.895 -173.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.436 HG22 HD11 ' B' 1015 ' ' ILE . 1.6 m -65.16 -22.97 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.401 0.619 . . . . 2.0299999999999998 110.197 174.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.75 -42.85 19.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.205 0.526 . . . . 1.0600000000000001 110.049 175.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.411 ' HA ' ' CD2' ' A' ' 90' ' ' LEU . 22.5 t80 -54.71 -55.11 33.34 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.891 -1.05 . . . . 1.8400000000000001 111.358 177.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.81 ' HA ' ' HE2' ' A' ' 130' ' ' MET . 0.2 OUTLIER -70.87 -20.56 62.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.014 0.435 . . . . 4.21 110.292 -176.501 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.683 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 33.7 t -73.02 -50.61 22.1 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.927 -0.579 . . . . 1.55 110.362 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -70.28 -26.8 63.97 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 116.512 -0.313 . . . . 3.6400000000000001 110.216 -178.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.708 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -70.44 -36.03 68.97 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.215 -0.993 . . . . 0.32000000000000001 111.38 174.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.796 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -69.22 -33.88 74.32 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 110.855 -0.898 . . . . 0.23999999999999999 110.855 173.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.663 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -69.81 -33.61 72.57 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.136 -0.532 . . . . 1.05 110.643 175.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.579 ' HB3' HD12 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -59.19 -39.78 83.67 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.253 1.025 . . . . 1.78 108.625 -179.723 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.631 ' SG ' HG13 ' A' ' 123' ' ' VAL . 35.6 t -53.0 -53.82 44.4 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 113.622 -1.626 . . . . 0.90000000000000002 110.604 173.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.47 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 93.5 t -65.8 -38.44 82.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.261 -0.427 . . . . 1.2 111.07 -178.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.534 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 31.1 mt-10 -56.1 -34.06 65.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.015 0.436 . . . . 2.5099999999999998 110.287 175.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.428 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 45.9 m -74.64 -39.13 62.28 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.412 0.625 . . . . 0.28000000000000003 109.333 178.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 111' ' ' CYS . 91.0 t -66.37 -34.37 69.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.095 -0.957 . . . . 1.8300000000000001 109.565 -179.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -52.12 -48.89 64.57 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.575 -1.648 . . . . 0.59999999999999998 111.196 178.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.428 ' CG ' ' HE2' ' A' ' 119' ' ' MET . 28.7 mmtt -88.05 12.47 13.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.718 -0.674 . . . . 2.1600000000000001 110.419 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.417 ' HA ' HE21 ' A' ' 120' ' ' GLN . 44.9 mt-10 60.11 46.31 10.78 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.876 0.846 . . . . 1.8799999999999999 110.714 -177.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.456 ' HE3' HG22 ' A' ' 74' ' ' ILE . 27.3 mtm -118.69 45.86 1.96 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.462 -1.244 . . . . 1.0800000000000001 107.738 178.376 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.417 HE21 ' HA ' ' A' ' 118' ' ' GLU . 4.5 mt-30 -61.01 -7.28 2.36 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.373 -1.285 . . . . 1.1499999999999999 113.156 -175.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.566 HG21 HD22 ' A' ' 122' ' ' LEU . 28.3 m -66.61 -25.8 35.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 O-C-N 122.025 -0.422 . . . . 1.1899999999999999 111.197 173.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.768 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.4 mm? -71.91 -27.05 62.57 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 110.268 -0.271 . . . . 1.0600000000000001 110.268 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.631 HG13 ' SG ' ' A' ' 111' ' ' CYS . 60.7 t -43.48 -53.6 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 123.777 0.673 . . . . 1.0 112.184 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.575 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 4.8 t -75.11 -34.62 61.73 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.749 -0.38 . . . . 1.6599999999999999 110.542 -179.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.768 ' HD2' HD13 ' A' ' 122' ' ' LEU . 82.4 mtt180 -63.83 -51.6 63.93 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.243 -0.435 . . . . 3.2999999999999998 110.787 -177.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.642 ' O ' ' HB2' ' A' ' 130' ' ' MET . 89.7 mt -54.52 -47.79 70.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.878 -0.601 . . . . 1.0600000000000001 110.663 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.66 ' HB2' HD23 ' A' ' 13' ' ' LEU . . . -56.93 -25.53 57.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.239 -0.437 . . . . 1.1000000000000001 111.962 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.678 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -68.75 -67.03 0.5 Allowed 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 121.117 0.484 . . . . 1.1200000000000001 110.356 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.624 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 37.6 p-90 -75.69 -17.28 60.0 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.318 -0.855 . . . . 4.7699999999999996 111.809 -176.132 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.81 ' HE2' ' HA ' ' A' ' 104' ' ' PHE . 0.3 OUTLIER -65.09 -44.68 88.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.428 . . . . 1.0900000000000001 109.977 173.143 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.459 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -72.65 -38.87 67.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.385 -0.371 . . . . 1.05 110.125 176.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.573 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 38.0 m -59.76 -45.25 92.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.064 -0.517 . . . . 1.1299999999999999 111.678 175.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.418 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 0.7 OUTLIER -56.11 -41.24 74.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.807 0.337 . . . . 3.3500000000000001 110.578 177.693 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.753 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.4 tt -62.52 -50.54 70.98 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.864 -0.791 . . . . 1.5900000000000001 108.864 173.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . 0.409 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 5.2 m-80 -51.26 -48.57 62.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.879 -0.6 . . . . 0.46000000000000002 112.398 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -80.99 -50.42 9.72 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.294 0.479 . . . . 0.58999999999999997 112.294 -175.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . 0.418 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 1.7 m80 -90.64 -51.58 5.32 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.656 0.613 . . . . 2.3399999999999999 112.656 -171.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.753 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -81.47 -46.98 13.76 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.612 0.968 . . . . 1.8999999999999999 113.612 -168.644 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.714 ' HA ' HD11 ' A' ' 142' ' ' ILE . 34.1 tt0 -44.19 -52.92 14.94 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 113.259 0.837 . . . . 0.75 113.259 -172.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 38.8 Cg_exo -59.5 -44.23 33.97 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 121.647 1.565 . . . . 0.87 111.529 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . 0.551 ' CD1' HG11 ' A' ' 95' ' ' VAL . 1.5 t-105 -63.79 -42.93 97.63 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.48 -0.782 . . . . 1.4299999999999999 110.203 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.714 HD11 ' HA ' ' A' ' 139' ' ' GLU . 49.5 mt -48.68 -50.25 13.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.053 0.454 . . . . 1.1299999999999999 111.128 173.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.553 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.5 mm-40 -59.96 -31.79 70.21 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.521 -0.763 . . . . 0.57999999999999996 111.46 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.2 mm-40 -65.14 -19.42 65.97 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.599 0.714 . . . . 0.78000000000000003 110.733 176.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -111.16 5.14 19.85 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.198 -0.91 . . . . 0.93000000000000005 110.408 -175.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 117.17 -42.26 1.9 Allowed Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.626 -0.715 . . . . 0.56000000000000005 113.071 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . 0.564 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 132.8 -176.2 19.61 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.369 -0.92 . . . . 0.48999999999999999 112.343 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.681 ' HZ2' ' HG3' ' A' ' 139' ' ' GLU . 12.9 m-90 -73.16 -47.24 45.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.046 0.451 . . . . 4.5199999999999996 110.495 -177.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -59.85 -41.42 91.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.654 -0.703 . . . . 1.96 110.494 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.589 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 86.3 m -56.1 -35.22 66.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.924 -0.58 . . . . 1.24 111.404 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.954 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 64.4 t80 -61.1 -45.12 96.0 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.875 -0.33 . . . . 3.7200000000000002 110.202 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.577 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -70.49 -24.6 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.474 0.654 . . . . 1.8600000000000001 109.869 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -66.81 -22.99 66.0 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.276 -0.42 . . . . 1.6699999999999999 110.403 173.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.1 mt -98.03 -55.84 2.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.296 0.57 . . . . 1.96 110.88 178.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . 0.411 ' HD2' ' HB1' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -121.7 27.41 8.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.439 -0.8 . . . . 4.3899999999999997 110.416 -170.712 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.668 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -58.14 167.0 6.21 Favored Glycine 0 CA--C 1.503 -0.709 0 CA-C-O 121.834 0.686 . . . . 1.1000000000000001 114.24 -178.042 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.718 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 28.5 t-20 -54.43 130.01 37.89 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 113.68 -1.26 . . . . 1.29 111.224 -177.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.71 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 4.1 m120 -65.39 -28.39 69.23 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.502 0.556 . . . . 3.4399999999999999 112.502 -173.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . 0.418 ' HB1' ' OD1' ' A' ' 157' ' ' ASN . . . -60.56 -29.41 69.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.163 0.506 . . . . 2.6699999999999999 110.32 176.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -87.06 -36.68 18.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.099 -0.501 . . . . 2.8700000000000001 110.206 174.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 0.485 ' HB2' ' HA ' ' A' ' 158' ' ' ASN . . . -59.77 -50.57 73.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.891 -0.595 . . . . 3.2000000000000002 111.354 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.71 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 9.2 pt-20 -60.27 -27.5 67.3 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.637 -0.256 . . . . 3.7200000000000002 111.378 176.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 18.1 t -67.77 -40.55 84.01 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.629 -0.508 . . . . 4.2000000000000002 109.629 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 4.6 mpt_? -80.89 -0.32 38.62 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 121.203 0.525 . . . . 6.3700000000000001 110.52 176.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -86.85 -13.59 44.52 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.979 -0.555 . . . . 5.0099999999999998 109.763 176.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -63.82 -17.77 61.04 Favored Glycine 0 N--CA 1.451 -0.303 0 CA-C-N 115.642 -0.708 . . . . 5.0999999999999996 113.325 -174.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -69.53 -20.88 63.69 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 122.603 -0.351 . . . . 5.9400000000000004 111.172 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . 0.547 ' HA ' ' O ' ' A' ' 171' ' ' GLU . 25.8 mt-10 -81.23 2.92 25.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.957 0.408 . . . . 5.8799999999999999 110.686 178.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.421 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 3.5 tmt_? -64.91 -39.74 93.98 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.53 -0.915 . . . . 7.7999999999999998 108.53 173.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.433 HD22 ' HA ' ' A' ' 170' ' ' LEU . 0.3 OUTLIER -106.0 -47.78 3.77 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.463 -0.789 . . . . 7.29 109.932 176.707 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . 0.547 ' O ' ' HA ' ' A' ' 168' ' ' GLU . 40.5 mm-40 -89.07 91.6 8.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.342 0.592 . . . . 6.9699999999999998 111.455 -177.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 63.7 t60 -166.12 24.27 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.551 -0.907 . . . . 9.8100000000000005 108.551 -178.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 30.3 t-80 -133.34 30.06 3.91 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.389 -0.823 . . . . 11.99 110.278 -174.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 9.1 t-160 -65.75 -28.92 69.39 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.988 0.423 . . . . 11.949999999999999 110.061 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -113.78 153.82 28.42 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.106 -0.497 . . . . 14.949999999999999 110.227 174.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -83.4 118.99 24.09 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.008 -0.542 . . . . 15.880000000000001 109.778 178.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -104.71 107.18 17.99 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.516 -0.311 . . . . 16.02 110.606 -177.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 78.3 mt 62.67 -174.04 0.15 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.582 -0.736 . . . . 18.210000000000001 111.291 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -97.51 -6.94 32.54 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.054 0.454 . . . . 19.219999999999999 110.234 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -92.94 109.76 21.21 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.928 -0.578 . . . . 22.800000000000001 110.068 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -79.91 -51.3 9.29 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.083 -0.508 . . . . 22.510000000000002 110.418 -177.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 64.45 87.61 0.11 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.542 -0.754 . . . . 25.300000000000001 110.503 -179.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -109.95 92.16 3.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.15 -0.477 . . . . 25.77 110.112 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -116.91 -17.02 10.51 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.016 -0.538 . . . . 27.370000000000001 110.139 -178.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.454 -0.784 . . . . 29.52 110.125 179.482 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.109 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . 87.35 -87.34 1.54 Allowed Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.615 -0.802 . . . . 2.9900000000000002 111.916 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.443 ' HA ' ' C2 ' ' B' 1100 ' ' 33B . 4.6 m 56.78 -149.32 0.47 Allowed 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 122.957 0.503 . . . . 1.9399999999999999 111.835 176.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.699 ' HA ' ' CD2' ' B' 1008 ' ' LEU . 2.7 m 39.72 -88.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.344 0.353 0 C-N-CA 124.961 1.304 . . . . 1.9399999999999999 113.578 176.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 0.416 ' H ' HG22 ' B' 1004 ' ' VAL . . . -33.91 -33.48 0.02 OUTLIER Glycine 0 CA--C 1.536 1.405 0 CA-C-N 117.989 0.359 . . . . 1.26 113.977 165.41 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B 1006 ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' B' 1009 ' ' ALA . 18.4 mmt180 -107.38 -37.04 6.34 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.672 0.619 . . . . 3.4500000000000002 112.672 177.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B 1007 ' ' ALA . . . . . 0.553 ' HB1' ' O2 ' ' B' 1100 ' ' 33B . . . -71.34 -61.6 1.71 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.884 0.698 . . . . 1.54 112.884 -165.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.699 ' CD2' ' HA ' ' B' 1004 ' ' VAL . 1.9 mm? -61.86 -41.96 98.47 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.138 -0.689 . . . . 1.8999999999999999 109.138 -177.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 0.735 ' HA ' HH12 ' A' ' 99' ' ' ARG . . . -38.48 -56.87 1.22 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.333 -1.303 . . . . 1.45 111.645 169.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.58 ' HB2' ' H13' ' B' 1100 ' ' 33B . . . -73.51 -42.58 61.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.535 -1.211 . . . . 1.51 112.005 -174.003 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.606 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 31.0 m-85 -70.86 -20.79 62.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.062 -0.517 . . . . 2.0699999999999998 111.476 -177.081 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -75.52 -23.39 73.31 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.841 -0.695 . . . . 0.80000000000000004 112.928 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.75 -19.51 62.53 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.988 0.423 . . . . 1.8999999999999999 111.09 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 18.6 m -87.03 -14.4 41.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.335 -0.393 . . . . 1.4399999999999999 111.2 -173.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.436 HD11 HG22 ' A' ' 101' ' ' VAL . 56.8 mt -76.1 -70.56 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 110.008 -0.367 . . . . 3.4300000000000002 110.008 -178.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -124.52 95.73 4.64 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.157 -0.474 . . . . 4.79 109.835 176.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 13.1 tpt180 -91.13 -71.78 0.61 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.033 -0.531 . . . . 8.9800000000000004 110.376 178.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 116.697 -0.228 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.753 ' O62' ' C2 ' ' B' 1100 ' ' 33B . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.617 ' HG3' HG21 ' A' ' 41' ' ' THR . 26.5 mmt . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 109.828 -0.434 . . . . 6.4500000000000002 109.828 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.0 t -132.82 -24.09 1.97 Allowed 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.924 -0.31 . . . . 2.2599999999999998 111.441 -179.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.7 tp60 -100.38 1.19 41.17 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.333 0.587 . . . . 2.7599999999999998 110.714 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.5 p -71.12 -12.33 61.44 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.975 -0.557 . . . . 1.54 111.388 -179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.869 ' HA ' HD21 ' A' ' 8' ' ' LEU . 3.4 p30 -66.29 -25.39 66.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.817 -0.628 . . . . 1.78 111.043 176.283 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.634 ' NH1' ' HB ' ' A' ' 30' ' ' VAL . 15.0 tpp85 -55.62 -50.37 70.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.933 -0.576 . . . . 1.8999999999999999 110.618 175.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.51 ' CD ' ' HG ' ' A' ' 43' ' ' SER . 34.7 mt-10 -59.41 -49.51 77.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.444 -0.798 . . . . 0.68000000000000005 111.007 -176.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.869 HD21 ' HA ' ' A' ' 5' ' ' ASN . 0.1 OUTLIER -47.73 -39.45 17.75 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.102 -0.954 . . . . 1.8 111.287 176.874 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.3 t -73.13 -62.08 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.122 0.487 . . . . 1.0700000000000001 110.253 176.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 6' ' ' ARG . 86.1 t -49.88 -49.15 21.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.17 -0.923 . . . . 1.1299999999999999 113.092 -176.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -53.72 -37.21 63.09 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.797 0.332 . . . . 0.58999999999999997 110.845 -176.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.593 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 21.5 t80 -78.47 -44.2 25.18 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.293 -0.412 . . . . 2.02 111.007 -178.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.804 HD22 ' HB2' ' A' ' 127' ' ' ALA . 6.1 mp -58.03 -42.7 85.88 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 120.435 -0.506 . . . . 1.0600000000000001 109.905 177.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.1 t -58.95 -44.91 91.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.79 -0.641 . . . . 1.6000000000000001 110.594 177.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.423 ' O ' ' HB3' ' A' ' 18' ' ' SER . 61.3 t80 -69.18 -29.61 67.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.971 -0.559 . . . . 1.49 110.844 -178.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.639 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 9.5 mmpt? -74.58 -32.24 62.32 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 120.666 0.27 . . . . 1.8400000000000001 110.879 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.613 HD23 ' O ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -68.4 -28.17 66.86 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 120.283 -0.567 . . . . 1.98 109.626 174.737 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.423 ' HB3' ' O ' ' A' ' 15' ' ' TYR . 45.1 t -62.5 -36.17 81.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.651 -0.704 . . . . 1.3799999999999999 112.06 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -79.07 -0.01 29.71 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.367 0.604 . . . . 1.51 111.243 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.584 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 19.9 mmmt -112.97 -28.66 7.63 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.783 0.801 . . . . 2.6499999999999999 109.09 178.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.36 21.1 11.02 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.119 -1.401 . . . . 0.54000000000000004 111.569 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.584 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 94.4 m-85 -110.2 167.24 10.34 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.571 -0.314 . . . . 1.1200000000000001 110.24 178.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.573 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 6.6 t -111.47 149.97 30.56 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.034 0.445 . . . . 0.75 110.866 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.569 ' HZ2' ' HG2' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -65.47 -50.4 65.48 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.474 -0.785 . . . . 4.29 110.379 173.555 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.9 t -70.42 -24.63 62.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 1.8600000000000001 111.588 -172.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.573 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 92.7 mt-30 -57.7 -32.29 67.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.006 0.432 . . . . 1.52 110.997 177.535 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.497 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 16.4 m-85 -114.76 -16.44 11.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.1 -0.5 . . . . 1.53 111.674 -173.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.6 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 24.8 m -100.97 152.04 21.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.721 0.772 . . . . 2.04 112.661 -175.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.443 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 2.7 t70 -127.81 -8.69 5.54 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.244 -1.344 . . . . 2.3100000000000001 109.842 -177.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.678 HG22 ' H ' ' A' ' 31' ' ' GLU . 3.3 m -51.39 -72.88 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.196 -1.365 . . . . 1.4099999999999999 113.041 -169.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.678 ' H ' HG22 ' A' ' 30' ' ' VAL . 1.7 pm0 -100.57 3.04 42.38 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.089 0.471 . . . . 2.7400000000000002 110.337 174.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.443 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 19.7 tt0 -58.25 -53.75 54.75 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.618 -0.719 . . . . 1.45 111.324 178.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -87.11 -58.98 2.38 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.818 -0.628 . . . . 1.8700000000000001 111.445 -172.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.0 ptt180 -98.96 141.5 31.65 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.985 0.422 . . . . 3.8199999999999998 109.881 175.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 4.2 p -117.54 98.87 6.62 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 121.711 0.767 . . . . 2.6699999999999999 110.942 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 1.016 ' HG3' ' H ' ' A' ' 37' ' ' ALA . 11.2 pt-20 -93.29 -72.3 0.61 Allowed 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 114.624 -1.171 . . . . 3.3399999999999999 110.496 -176.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 1.016 ' H ' ' HG3' ' A' ' 36' ' ' GLU . . . -63.54 162.73 24.5 Favored Pre-proline 0 C--N 1.308 -1.202 0 CA-C-N 114.119 -1.401 . . . . 2.4399999999999999 112.164 178.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.755 ' HG3' ' HB ' ' A' ' 41' ' ' THR . 47.7 Cg_endo -64.25 -178.98 0.71 Allowed 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 124.622 3.548 . . . . 1.8700000000000001 112.89 176.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -87.21 -5.49 58.95 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.868 -0.79 . . . . 4.6399999999999997 108.868 168.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.619 ' H ' ' HB2' ' A' ' 38' ' ' PRO . . . 156.29 72.91 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 114.947 -1.024 . . . . 2.3999999999999999 111.771 -179.211 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.919 HG22 ' H ' ' A' ' 42' ' ' GLU . 1.8 t -60.88 -74.42 0.08 Allowed 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 109.961 -0.385 . . . . 1.45 109.961 -177.054 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.919 ' H ' HG22 ' A' ' 41' ' ' THR . 11.2 pt-20 -94.98 -29.05 14.83 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 122.96 1.362 . . . . 2.02 108.211 164.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.51 ' HG ' ' CD ' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -62.91 -26.3 68.73 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 112.021 -2.354 . . . . 1.25 114.107 -166.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.562 ' HB2' ' HA3' ' A' ' 40' ' ' GLY . 42.2 tt0 -55.56 -42.23 74.4 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.918 -0.313 . . . . 1.9099999999999999 110.411 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.509 ' HB2' HG22 ' A' ' 152' ' ' VAL . . . -79.48 -37.33 37.03 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.97 0.414 . . . . 1.1799999999999999 110.354 176.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.65 ' HA ' ' CG1' ' A' ' 152' ' ' VAL . 99.7 t -58.11 -60.96 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.683 -0.69 . . . . 2.0099999999999998 111.353 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.469 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 10.6 ptpt -59.41 -34.62 72.69 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.365 -0.605 . . . . 1.3799999999999999 109.365 -178.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.519 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 4.7 mm100 -66.59 -32.44 73.78 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.439 -0.801 . . . . 0.98999999999999999 111.01 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.719 ' HB3' ' HA2' ' A' ' 156' ' ' GLY . . . -82.88 -35.02 26.55 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.303 0.573 . . . . 1.1399999999999999 110.3 176.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.445 HD12 ' CE2' ' A' ' 151' ' ' PHE . 1.1 tp -63.06 -31.38 72.51 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.245 -0.889 . . . . 1.95 111.468 -177.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.519 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 9.5 ptp180 -79.05 -30.24 43.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.661 0.743 . . . . 2.5099999999999998 109.098 -178.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.648 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.4 mm-40 -68.9 -47.93 64.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.58 -1.191 . . . . 1.1000000000000001 109.799 177.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.2 -36.8 82.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.427 -0.806 . . . . 1.04 110.073 174.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.695 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.73 -44.05 98.4 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.46 -0.791 . . . . 0.69999999999999996 112.144 179.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.476 ' O ' HD22 ' A' ' 59' ' ' LEU . 23.9 t70 -55.2 -39.65 69.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.785 0.326 . . . . 1.04 110.774 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.3 mm-40 -65.38 -26.45 68.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.36 -0.836 . . . . 2.29 111.658 178.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -82.84 -33.51 27.09 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.516 -0.311 . . . . 2.9300000000000002 111.205 175.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.766 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 38.2 mt-10 -69.4 -53.37 19.76 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 112.374 0.509 . . . . 1.3 112.374 -165.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.479 HD21 ' N ' ' A' ' 59' ' ' LEU . 2.3 pt? -52.31 -35.18 49.99 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 123.608 0.568 . . . . 2.1899999999999999 110.477 -177.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 75.7 mtt180 -61.4 -58.86 6.48 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.424 -0.807 . . . . 3.1400000000000001 112.055 -178.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.766 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 8.9 p90 -91.32 -6.57 52.9 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.028 0.381 . . . . 5.5899999999999999 112.028 -173.255 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.483 ' HB2' ' O ' ' A' ' 58' ' ' GLU . 17.7 tpp85 -62.84 -30.77 71.75 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.95 0.352 . . . . 4.9299999999999997 111.95 -171.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -65.16 -39.88 93.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.907 0.384 . . . . 5.3499999999999996 110.196 178.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.444 ' HB1' ' CD1' ' A' ' 68' ' ' LEU . . . -77.21 -41.27 41.98 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.025 -0.534 . . . . 1.7 110.858 176.563 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.679 ' CZ ' ' HB3' ' A' ' 109' ' ' ALA . 39.4 t80 -43.42 -47.94 7.06 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.959 0.725 . . . . 3.52 112.959 -174.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.3 p -60.01 -37.17 78.95 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.785 0.326 . . . . 2.5899999999999999 111.627 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -86.49 -29.62 22.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.311 0.576 . . . . 2.7200000000000002 110.642 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.444 ' CD1' ' HB1' ' A' ' 64' ' ' ALA . 2.0 mp -59.73 -16.87 30.44 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.27 -0.877 . . . . 2.25 112.596 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.487 ' CG2' ' HG3' ' A' ' 113' ' ' GLU . 2.2 p -57.88 -27.81 63.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.839 0.291 . . . . 1.26 111.686 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -71.99 -33.75 68.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.652 0.739 . . . . 1.8 109.327 174.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -77.03 -38.39 52.97 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.123 -0.944 . . . . 1.8899999999999999 110.036 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.66 HD21 ' HZ ' ' A' ' 106' ' ' PHE . 3.1 mm? -65.87 -32.87 74.63 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.559 -0.292 . . . . 1.98 110.514 172.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.406 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 59.7 m80 63.25 41.08 8.17 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.332 -0.988 . . . . 3.54 108.332 -172.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.526 HG22 ' HB3' ' A' ' 113' ' ' GLU . 31.5 mm -46.71 115.22 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 113.975 -1.466 . . . . 1.1499999999999999 112.057 -177.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.727 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.15 -174.83 0.45 Allowed Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 114.746 -1.115 . . . . 1.1200000000000001 108.117 -168.234 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.727 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 23.4 Cg_exo -30.3 166.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 125.166 3.911 . . . . 0.53000000000000003 115.001 165.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.596 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -28.82 -34.01 0.01 OUTLIER Glycine 0 N--CA 1.469 0.895 0 N-CA-C 116.931 1.532 . . . . 0.40999999999999998 116.931 -170.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.448 ' N ' ' O ' ' A' ' 76' ' ' PRO . 22.2 p -62.32 3.87 0.17 Allowed 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.893 0.701 . . . . 1.22 112.893 -179.383 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.54 -13.16 62.19 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.207 0.527 . . . . 1.0700000000000001 109.927 172.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.596 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 10.5 p90 -75.91 -18.29 59.44 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.526 -0.546 . . . . 4.3099999999999996 109.526 174.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.444 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 24.2 mt-30 -77.57 -32.55 53.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.878 0.847 . . . . 1.03 109.135 172.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.9 m -68.37 -52.28 34.89 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.283 -1.326 . . . . 0.47999999999999998 109.797 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.48 ' HA ' HG22 ' A' ' 86' ' ' VAL . 78.7 t80 -68.99 -17.97 63.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.046 -0.979 . . . . 1.4399999999999999 110.349 176.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.572 ' HA ' HG12 ' A' ' 87' ' ' VAL . 44.3 tt0 -64.47 -48.78 73.97 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.02 -0.536 . . . . 0.80000000000000004 110.502 177.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.456 ' OE1' HG23 ' B' 1004 ' ' VAL . 56.8 mt-30 -46.48 -35.45 5.67 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.715 -1.13 . . . . 1.99 110.302 176.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.729 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.4 t -81.47 -54.82 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.018 0 CA-C-N 114.455 -1.248 . . . . 1.8999999999999999 111.069 -176.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.572 HG12 ' HA ' ' A' ' 84' ' ' GLU . 10.6 p -58.11 -26.39 29.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.591 0.71 . . . . 1.4299999999999999 109.567 -178.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.479 ' O ' ' HB3' ' A' ' 92' ' ' ARG . 2.3 m-80 -68.07 -40.87 82.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.521 -1.218 . . . . 0.91000000000000003 111.833 175.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.946 ' HG2' ' HA2' ' B' 1005 ' ' GLY . 0.3 OUTLIER -79.41 -33.54 42.59 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-O 121.691 0.758 . . . . 2.8700000000000001 109.756 179.259 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.808 HD23 HH11 ' A' ' 99' ' ' ARG . 42.3 mt -68.31 -22.22 64.72 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 114.392 -1.277 . . . . 1.9199999999999999 112.146 -168.304 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.558 ' HD1' ' O ' ' A' ' 87' ' ' VAL . 6.2 p90 -108.75 -24.76 11.16 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.719 -0.392 . . . . 2.9700000000000002 111.93 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.59 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -68.45 -25.69 65.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.823 0.344 . . . . 5.6699999999999999 111.685 -171.719 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.427 ' HB3' ' NH2' ' A' ' 99' ' ' ARG . 26.8 t70 -97.61 -1.27 44.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.198 -0.456 . . . . 3.1200000000000001 111.945 -170.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.03 67.86 0.11 Allowed Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 118.847 -1.644 . . . . 2.3100000000000001 113.335 -176.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.58 HG12 ' CD1' ' A' ' 141' ' ' TRP . 0.2 OUTLIER -70.54 100.61 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 123.045 1.402 . . . . 1.6799999999999999 110.85 -177.485 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.411 ' H ' ' ND2' ' A' ' 96' ' ' ASN . 0.2 OUTLIER -110.19 -171.53 1.85 Allowed 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 113.124 -1.853 . . . . 2.1200000000000001 108.782 172.108 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.692 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 16.0 m-90 -46.09 -52.37 12.17 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.732 0.645 . . . . 4.1200000000000001 110.964 178.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.431 ' HA3' HD13 ' B' 1015 ' ' ILE . . . -65.43 -28.14 73.26 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.362 -0.835 . . . . 0.80000000000000004 114.414 -175.104 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.808 HH11 HD23 ' A' ' 90' ' ' LEU . 12.7 mmt180 -72.22 -38.0 69.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.156 0.478 . . . . 4.9100000000000001 111.176 -175.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.55 HG12 ' HG ' ' A' ' 138' ' ' LEU . 94.1 mt -70.29 -33.06 52.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.725 -0.67 . . . . 1.1100000000000001 110.404 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.489 HG21 ' O ' ' A' ' 97' ' ' TRP . 47.0 t -56.31 -54.59 26.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.356 -0.838 . . . . 2.0299999999999998 109.935 170.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -51.1 -47.58 61.9 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.774 -0.648 . . . . 1.0600000000000001 111.013 176.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.557 ' HA ' HD13 ' A' ' 90' ' ' LEU . 11.3 t80 -55.3 -53.1 60.43 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.939 -1.028 . . . . 1.8400000000000001 111.993 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.569 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.2 OUTLIER -76.6 -21.85 55.02 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.794 -0.362 . . . . 4.21 110.685 -175.033 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.593 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 47.1 t -70.08 -54.66 12.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 1.55 110.615 177.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.66 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 41.9 t80 -64.31 -26.6 68.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.039 0.447 . . . . 3.6400000000000001 109.873 178.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.498 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -69.72 -46.96 51.44 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.809 -0.632 . . . . 0.32000000000000001 112.653 178.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.793 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -60.42 -33.46 81.23 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.36 -0.924 . . . . 0.23999999999999999 110.942 175.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.679 ' HB3' ' CZ ' ' A' ' 65' ' ' PHE . . . -72.11 -30.46 65.09 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.023 -0.589 . . . . 1.05 111.01 176.691 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.7 -42.42 99.63 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.731 -0.84 . . . . 1.78 108.731 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.639 ' SG ' HG13 ' A' ' 123' ' ' VAL . 32.9 t -50.32 -53.22 30.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.915 -1.493 . . . . 0.90000000000000002 110.933 174.054 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.534 HG12 ' HG3' ' A' ' 20' ' ' LYS . 53.1 t -62.52 -44.64 99.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.884 -0.598 . . . . 1.2 111.962 -176.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.526 ' HB3' HG22 ' A' ' 74' ' ' ILE . 21.2 mm-40 -60.79 -26.04 66.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.929 0.395 . . . . 2.5099999999999998 111.381 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.53 ' HA ' ' HE1' ' A' ' 119' ' ' MET . 23.7 m -73.35 -38.51 65.72 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.617 -0.883 . . . . 0.28000000000000003 108.617 174.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.61 HG23 ' O ' ' A' ' 111' ' ' CYS . 88.2 t -68.73 -37.36 77.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.257 -0.883 . . . . 1.8300000000000001 109.479 -178.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -55.78 -51.02 68.84 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 113.531 -1.668 . . . . 0.59999999999999998 111.516 -177.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.518 ' HG2' ' O ' ' A' ' 113' ' ' GLU . 15.0 mmtt -85.79 15.89 4.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.937 -0.574 . . . . 2.1600000000000001 110.071 -178.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.468 ' HA ' HE21 ' A' ' 120' ' ' GLN . 38.4 mt-10 65.19 48.32 2.22 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.524 -0.762 . . . . 1.8799999999999999 110.832 178.33 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.53 ' HE1' ' HA ' ' A' ' 114' ' ' SER . 25.5 mtm -128.15 43.36 3.15 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.044 -1.095 . . . . 1.0800000000000001 108.044 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.577 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 1.6 mt-30 -61.47 -7.69 3.4 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.976 -1.011 . . . . 1.1499999999999999 113.131 -175.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.584 HG23 HD21 ' A' ' 122' ' ' LEU . 25.6 m -66.5 -24.78 33.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 122.042 -0.411 . . . . 1.1899999999999999 111.079 174.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.644 HD11 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -71.7 -27.02 62.74 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 116.537 -0.301 . . . . 1.0600000000000001 110.19 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.639 HG13 ' SG ' ' A' ' 111' ' ' CYS . 65.5 t -45.97 -54.03 2.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 123.735 0.647 . . . . 1.0 112.116 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.6 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 3.4 t -74.95 -26.02 59.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.901 0.381 . . . . 1.6599999999999999 110.491 -177.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.644 ' HD2' HD11 ' A' ' 122' ' ' LEU . 91.4 mtt180 -71.5 -53.15 14.85 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.337 -0.392 . . . . 3.2999999999999998 110.002 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.54 HD11 ' HA ' ' A' ' 111' ' ' CYS . 76.2 mt -54.46 -50.39 58.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.594 -0.73 . . . . 1.0600000000000001 111.532 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.804 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -57.13 -37.07 71.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.871 0.367 . . . . 1.1000000000000001 110.967 179.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -61.52 -56.96 14.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.701 0.762 . . . . 1.1200000000000001 110.241 175.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.516 ' CZ2' ' HB3' ' A' ' 125' ' ' ARG . 36.4 m0 -56.79 -46.51 81.49 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.148 -1.387 . . . . 4.7699999999999996 110.754 -178.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.568 ' SD ' HD11 ' A' ' 13' ' ' LEU . 88.6 mtp -59.36 -54.07 51.0 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.985 -0.552 . . . . 1.0900000000000001 111.459 -177.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.78 -34.24 75.52 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.044 -0.526 . . . . 1.05 110.318 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 54.9 m -65.81 -48.82 70.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.186 -0.461 . . . . 1.1299999999999999 111.004 175.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.499 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 6.5 m-85 -54.56 -42.58 71.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.438 -0.346 . . . . 3.3500000000000001 110.471 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.781 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.7 tt -61.59 -50.53 72.21 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 109.029 -0.73 . . . . 1.5900000000000001 109.029 173.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -50.51 -56.44 11.61 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.247 0.462 . . . . 0.46000000000000002 112.247 179.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.49 -48.23 15.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.069 0.461 . . . . 0.58999999999999997 111.866 -171.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . 0.499 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 52.4 m-70 -90.49 -51.49 5.38 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 112.7 0.63 . . . . 2.3399999999999999 112.7 -170.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.781 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -86.07 -42.59 13.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 114.552 1.315 . . . . 1.8999999999999999 114.552 -165.716 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.648 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 27.5 tt0 -43.85 -51.8 16.38 Favored Pre-proline 0 N--CA 1.47 0.539 0 N-CA-C 112.797 0.666 . . . . 0.75 112.797 -173.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.559 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 47.6 Cg_exo -55.08 -46.06 36.01 Favored 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 121.901 1.734 . . . . 0.87 111.824 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . 0.58 ' CD1' HG12 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -61.39 -41.02 96.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.581 -0.736 . . . . 1.4299999999999999 110.802 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.546 HD11 ' HA ' ' A' ' 139' ' ' GLU . 3.5 mt -54.55 -47.64 71.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.103 0.478 . . . . 1.1299999999999999 110.628 174.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.648 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 67.0 mm-40 -58.24 -34.19 70.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.415 -0.811 . . . . 0.57999999999999996 110.916 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.4 mm-40 -65.19 -23.17 67.02 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 121.46 0.647 . . . . 0.78000000000000003 110.892 178.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.619 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -102.12 2.74 37.8 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.164 -0.926 . . . . 0.93000000000000005 109.315 -174.656 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.6 -44.14 1.53 Allowed Glycine 0 N--CA 1.439 -1.1 0 CA-C-N 114.813 -1.085 . . . . 0.56000000000000005 112.436 177.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 138.66 175.78 14.18 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.728 -0.749 . . . . 0.48999999999999999 111.911 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.418 ' HZ3' ' O ' ' A' ' 1' ' ' MET . 5.5 m-90 -68.27 -43.93 76.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.776 0.322 . . . . 4.5199999999999996 110.697 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -63.11 -39.65 95.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.115 -0.493 . . . . 1.96 109.908 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.541 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 94.1 m -56.25 -36.67 68.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.605 -0.725 . . . . 1.24 111.069 177.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.692 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 75.1 t80 -59.98 -42.97 95.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.837 0.351 . . . . 3.7200000000000002 110.277 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.65 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.1 m -73.4 -24.75 20.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.408 0.623 . . . . 1.8600000000000001 110.05 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -64.49 -23.63 67.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.016 0.436 . . . . 1.6699999999999999 109.908 173.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 150' ' ' THR . 1.9 mt -98.52 -53.46 3.32 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.964 -0.562 . . . . 1.96 110.768 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -120.79 26.44 9.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.684 -0.689 . . . . 4.3899999999999997 111.436 -170.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.719 ' HA2' ' HB3' ' A' ' 49' ' ' ALA . . . -57.83 160.2 11.92 Favored Glycine 0 N--CA 1.448 -0.527 0 CA-C-N 116.102 -0.499 . . . . 1.1000000000000001 113.638 -177.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.648 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 28.7 t-20 -46.44 123.64 5.06 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 113.691 -1.254 . . . . 1.29 112.317 -177.072 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.699 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 4.8 m120 -71.81 -27.46 62.94 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 112.533 0.568 . . . . 3.4399999999999999 112.533 -173.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -61.39 -40.55 94.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.176 0.513 . . . . 2.6699999999999999 109.856 175.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.464 ' O ' ' HD3' ' A' ' 164' ' ' ARG . . . -74.13 -36.78 64.2 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.714 -0.675 . . . . 2.8700000000000001 109.991 174.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 0.5 ' HB2' ' HA ' ' A' ' 158' ' ' ASN . . . -58.17 -61.79 2.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.94 -0.573 . . . . 3.2000000000000002 111.382 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.699 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 8.0 pt-20 -55.68 -32.03 62.91 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 111.65 0.241 . . . . 3.7200000000000002 111.65 176.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 42.5 t -66.73 -45.5 78.47 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.028 0.442 . . . . 4.2000000000000002 110.285 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . 0.464 ' HD3' ' O ' ' A' ' 160' ' ' ALA . 10.0 mpt_? -75.3 -15.2 60.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.354 0.597 . . . . 6.3700000000000001 110.319 178.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 30.6 ttpt -78.45 -54.22 6.4 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.909 -1.041 . . . . 5.0099999999999998 110.116 174.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -65.9 -26.89 72.37 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.272 -0.876 . . . . 5.0999999999999996 113.504 -173.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.415 ' OE1' ' HA ' ' A' ' 164' ' ' ARG . 17.6 pt20 -67.33 -16.67 64.39 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.49 -0.418 . . . . 5.9400000000000004 110.997 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -82.24 -1.9 50.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.016 0.436 . . . . 5.8799999999999999 110.295 176.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.502 ' HD2' ' O ' ' A' ' 169' ' ' ARG . 5.7 tmm_? -84.33 -33.29 23.93 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.04 -1.096 . . . . 7.7999999999999998 108.04 173.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -77.79 -48.48 16.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.118 -0.946 . . . . 7.29 109.034 175.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 57.91 91.52 0.04 OUTLIER 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.039 -0.982 . . . . 6.9699999999999998 111.434 175.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 45.7 m80 -81.71 -11.38 59.07 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.837 -0.62 . . . . 9.8100000000000005 110.167 178.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -164.58 140.35 5.86 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.4 -0.963 . . . . 11.99 108.4 174.175 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 36.3 m80 -58.02 -53.95 52.43 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.384 0.427 . . . . 11.949999999999999 111.742 -174.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -90.89 170.86 9.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.765 0.316 . . . . 14.949999999999999 111.293 -177.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -54.37 143.67 22.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.668 -0.696 . . . . 15.880000000000001 110.922 178.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 9.4 p-80 -144.65 -175.97 4.87 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.87 -0.605 . . . . 16.02 110.27 -177.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 6.4 mp -65.83 -48.13 72.72 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 123.177 0.298 . . . . 18.210000000000001 111.696 -171.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 61.38 20.81 11.45 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.247 0.342 . . . . 19.219999999999999 111.554 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 56.98 37.49 28.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 22.800000000000001 110.747 -176.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 -68.34 -24.69 64.84 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-N 115.844 -0.616 . . . . 22.510000000000002 109.618 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 29.3 m80 -102.08 96.04 6.74 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.093 -0.706 . . . . 25.300000000000001 109.093 171.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -75.06 -35.15 61.87 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.07 -0.514 . . . . 25.77 110.492 -177.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 21.9 p-80 -117.26 148.34 41.75 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.013 -0.366 . . . . 27.370000000000001 110.013 178.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 35.8 t-80 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.369 -0.824 . . . . 29.52 110.245 -177.957 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.312 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -97.14 -44.58 2.77 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.809 -0.71 . . . . 2.9900000000000002 111.949 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.489 ' HA ' ' C2 ' ' B' 1100 ' ' 33B . 31.6 m -113.55 -147.73 0.42 Allowed 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.704 -0.48 . . . . 1.9399999999999999 109.704 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.93 HG21 ' H ' ' B' 1005 ' ' GLY . 17.6 m 53.07 -100.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 O-C-N 123.933 0.77 . . . . 1.9399999999999999 112.165 169.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 0.946 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . -46.21 -19.88 0.46 Allowed Glycine 0 CA--C 1.534 1.252 0 CA-C-N 118.968 0.804 . . . . 1.26 114.512 167.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B 1006 ' ' ARG . . . . . 0.437 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 6.6 mpt_? -98.87 -27.21 14.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 117.537 0.668 . . . . 3.4500000000000002 112.171 173.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B 1007 ' ' ALA . . . . . 0.464 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . . . -91.96 -65.44 1.01 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.235 0.457 . . . . 1.54 112.235 -169.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.595 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 18.2 mt -66.5 -35.91 81.44 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.946 -0.761 . . . . 1.8999999999999999 108.946 -176.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 0.71 ' HA ' HH12 ' A' ' 99' ' ' ARG . . . -42.25 -58.62 2.1 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.681 -1.145 . . . . 1.45 111.351 165.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.788 ' HB2' ' N11' ' B' 1100 ' ' 33B . . . -72.07 -40.21 68.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.136 -0.938 . . . . 1.51 111.789 -175.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.535 ' HE2' ' H8 ' ' B' 1100 ' ' 33B . 36.9 m-85 -67.65 -24.49 65.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.111 0.481 . . . . 2.0699999999999998 110.397 177.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B 1012 ' ' GLY . . . . . 0.548 ' O ' HG13 ' B' 1015 ' ' ILE . . . -79.64 -5.1 89.46 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.681 -0.69 . . . . 0.80000000000000004 112.456 178.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 20.8 t70 -74.85 -22.0 58.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.428 0.632 . . . . 1.8999999999999999 109.685 175.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 28.3 m -80.12 8.43 7.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.571 -0.74 . . . . 1.4399999999999999 112.33 -173.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.548 HG13 ' O ' ' B' 1012 ' ' GLY . 2.7 pp -87.79 4.5 4.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.572 -0.451 . . . . 3.4300000000000002 110.836 175.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -100.7 154.04 18.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.894 -0.594 . . . . 4.79 109.818 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -105.21 -79.88 0.55 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.818 0.342 . . . . 8.9800000000000004 110.166 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 116.65 -0.25 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.788 ' N11' ' HB2' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.465 ' HA ' ' OE1' ' A' ' 42' ' ' GLU . 26.5 ptt? . . . . . 0 N--CA 1.478 0.94 0 CA-C-O 120.569 0.223 . . . . 6.4500000000000002 110.869 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.3 p -72.12 -57.2 4.46 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.717 0.265 . . . . 2.2599999999999998 111.717 -174.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.673 ' HG3' ' HB3' ' A' ' 36' ' ' GLU . 37.8 tp60 -73.22 0.93 10.4 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.83 0.348 . . . . 2.7599999999999998 111.619 -174.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.413 ' OG ' ' HB3' ' A' ' 43' ' ' SER . 11.7 t -70.63 -15.2 62.71 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.068 0.461 . . . . 1.54 110.563 176.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.795 ' HA ' HD23 ' A' ' 8' ' ' LEU . 7.2 p30 -56.88 -20.83 25.3 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.269 -0.423 . . . . 1.78 111.226 176.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.559 ' HG2' ' HG3' ' A' ' 36' ' ' GLU . 6.8 tpp180 -59.49 -56.2 25.03 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.971 -0.559 . . . . 1.8999999999999999 110.393 174.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.42 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 42.5 mt-10 -57.01 -48.1 79.29 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 115.117 -0.947 . . . . 0.68000000000000005 110.968 -178.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.795 HD23 ' HA ' ' A' ' 5' ' ' ASN . 0.1 OUTLIER -49.17 -31.64 8.76 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.933 -1.031 . . . . 1.8 111.592 178.75 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.531 HG22 ' N ' ' A' ' 131' ' ' ALA . 78.3 t -81.04 -63.01 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-O 121.555 0.693 . . . . 1.0700000000000001 109.897 172.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 6' ' ' ARG . 55.2 t -54.18 -46.93 67.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.565 -1.198 . . . . 1.1299999999999999 113.066 -171.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -56.17 -38.99 71.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.66 0.267 . . . . 0.58999999999999997 110.979 -177.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.702 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 14.7 t80 -71.96 -42.19 66.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.302 -0.408 . . . . 2.02 110.217 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 1.009 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.5 mp -60.53 -41.18 93.92 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 120.499 -0.48 . . . . 1.0600000000000001 109.952 176.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.462 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 23.0 t -61.2 -47.39 86.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 1.6000000000000001 110.489 178.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -62.4 -30.95 71.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.78 -0.646 . . . . 1.49 110.738 177.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.698 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.4 OUTLIER -81.24 -33.83 32.55 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-N 116.109 -0.496 . . . . 1.8400000000000001 112.276 -173.815 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.582 ' O ' ' HD3' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -62.23 -27.73 69.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.371 0.605 . . . . 1.98 110.024 174.509 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.4 t -71.39 -16.25 62.4 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.627 -0.715 . . . . 1.3799999999999999 111.56 -176.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.698 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 19.7 pt20 -79.19 -12.76 59.97 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.356 0.598 . . . . 1.51 111.506 -176.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.753 ' NZ ' HG11 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -115.51 -20.05 10.37 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 122.197 0.999 . . . . 2.6499999999999999 109.412 179.415 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.28 28.97 5.59 Favored Glycine 0 C--N 1.306 -1.101 0 CA-C-N 113.696 -1.593 . . . . 0.54000000000000004 112.931 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -112.77 168.41 9.7 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.724 0.297 . . . . 1.1200000000000001 111.06 169.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.486 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 5.6 t -110.57 152.31 26.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.341 -0.391 . . . . 0.75 110.743 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.482 ' HA ' HD23 ' A' ' 17' ' ' LEU . 0.5 OUTLIER -75.19 -46.7 32.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.972 -0.558 . . . . 4.29 110.279 173.094 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.411 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 13.2 p -65.85 -25.34 67.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.358 -0.383 . . . . 1.8600000000000001 111.5 -173.366 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.486 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 97.3 mt-30 -63.43 -30.29 71.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.931 0.396 . . . . 1.52 111.051 176.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -121.85 18.51 11.01 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.052 -0.522 . . . . 1.53 111.777 -173.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.411 ' OG ' ' HA ' ' A' ' 25' ' ' SER . 93.3 p -101.02 -178.68 3.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.912 0.863 . . . . 2.04 113.156 -171.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.517 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.3 t70 -165.34 -25.52 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.586 -1.643 . . . . 2.3100000000000001 108.43 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.662 HG23 ' H ' ' A' ' 31' ' ' GLU . 15.2 m -55.29 -72.12 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 114.1 -1.409 . . . . 1.4099999999999999 113.014 -174.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.662 ' H ' HG23 ' A' ' 30' ' ' VAL . 34.8 mt-10 -90.17 0.03 57.38 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.759 0.79 . . . . 2.7400000000000002 108.873 177.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.517 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 30.8 tt0 -75.29 -52.13 11.58 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.53 -1.214 . . . . 1.45 110.453 -178.181 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -102.56 -38.72 7.41 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.672 -0.695 . . . . 1.8700000000000001 110.298 -178.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 11.6 mtp180 -93.42 157.98 15.95 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.199 0.524 . . . . 3.8199999999999998 111.516 177.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.1 p -138.04 94.36 2.87 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.069 -0.969 . . . . 2.6699999999999999 110.007 172.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.673 ' HB3' ' HG3' ' A' ' 3' ' ' GLN . 4.2 mm-40 -60.61 -90.8 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.072 -1.422 . . . . 3.3399999999999999 111.26 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.65 ' HB2' ' HD2' ' A' ' 38' ' ' PRO . . . -101.22 178.07 1.34 Allowed Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 108.709 -0.849 . . . . 2.4399999999999999 108.709 177.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.65 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 34.1 Cg_exo -52.12 151.88 15.83 Favored 'Trans proline' 0 N--CA 1.46 -0.485 0 C-N-CA 121.948 1.766 . . . . 1.8700000000000001 110.533 171.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -74.13 16.29 0.25 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.267 0.556 . . . . 4.6399999999999997 111.861 -173.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.445 ' H ' ' C ' ' A' ' 38' ' ' PRO . . . 163.4 61.5 0.02 OUTLIER Glycine 0 N--CA 1.437 -1.274 0 CA-C-N 115.766 -0.652 . . . . 2.3999999999999999 111.733 176.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.66 HG22 ' OE2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -81.55 -73.73 0.37 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 120.296 -0.561 . . . . 1.45 110.147 179.794 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.66 ' OE2' HG22 ' A' ' 41' ' ' THR . 0.0 OUTLIER -94.18 -32.85 13.54 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.806 0.812 . . . . 2.02 109.814 170.222 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.783 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 5.4 p -56.63 -36.29 69.3 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 113.94 -1.482 . . . . 1.25 113.613 -171.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -46.14 -43.65 15.14 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 123.311 0.382 . . . . 1.9099999999999999 111.894 -173.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.473 ' HB3' HG23 ' A' ' 152' ' ' VAL . . . -83.42 -36.86 23.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.777 0.322 . . . . 1.1799999999999999 110.482 176.124 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.653 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 79.0 t -54.91 -66.58 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 CA-C-N 115.753 -0.658 . . . . 2.0099999999999998 111.174 177.042 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.783 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.8 ptpt -58.26 -37.99 76.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.783 -0.644 . . . . 1.3799999999999999 110.353 -177.416 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.683 HE21 ' ND2' ' A' ' 157' ' ' ASN . 7.2 mm100 -63.84 -26.38 68.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.645 -0.707 . . . . 0.98999999999999999 111.402 175.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.545 ' HB1' ' HA2' ' A' ' 156' ' ' GLY . . . -84.97 -32.03 23.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.437 0.637 . . . . 1.1399999999999999 109.819 177.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 9.8 mt -67.91 -21.46 65.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.054 -0.976 . . . . 1.95 111.216 -175.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.582 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 13.0 ptp180 -89.73 -35.31 15.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.574 0.702 . . . . 2.5099999999999998 109.485 -178.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.697 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.0 mm-40 -67.65 -46.13 73.32 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.789 -1.096 . . . . 1.1000000000000001 109.396 175.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -71.44 -33.19 69.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.416 -0.811 . . . . 1.04 110.325 176.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.634 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -63.26 -43.63 98.21 Favored Glycine 0 CA--C 1.507 -0.463 0 CA-C-N 115.896 -0.593 . . . . 0.69999999999999996 111.759 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.601 ' O ' HD21 ' A' ' 59' ' ' LEU . 28.5 t70 -56.54 -34.74 67.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.873 0.368 . . . . 1.04 110.735 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -68.28 -26.85 65.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.288 -0.869 . . . . 2.29 111.72 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -83.25 -39.19 21.2 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.117 -0.492 . . . . 2.9300000000000002 111.352 176.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.754 ' HA ' ' CE2' ' A' ' 61' ' ' TYR . 43.6 mt-10 -66.97 -53.39 32.08 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 112.892 0.701 . . . . 1.3 112.892 -166.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.601 HD21 ' O ' ' A' ' 55' ' ' ASP . 2.3 pt? -51.31 -35.04 35.99 Favored 'General case' 0 C--N 1.32 -0.676 0 O-C-N 123.787 0.68 . . . . 2.1899999999999999 111.021 -172.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.414 ' H ' HD23 ' A' ' 59' ' ' LEU . 79.8 mtt-85 -64.82 -52.35 57.23 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.213 -0.903 . . . . 3.1400000000000001 111.621 -178.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.754 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 16.4 p90 -91.62 -14.43 30.2 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.082 0.401 . . . . 5.5899999999999999 112.082 -174.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -60.06 -17.29 38.32 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.029 0.381 . . . . 4.9299999999999997 112.029 -170.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -61.54 -36.64 81.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.016 0.436 . . . . 5.3499999999999996 110.72 177.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.605 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -91.43 -24.1 19.82 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.018 0.377 . . . . 1.7 112.018 -179.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.523 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 55.0 t80 -40.99 -52.97 3.07 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.621 0.971 . . . . 3.52 113.621 -171.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.0 t -69.09 -23.4 64.0 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.904 0.383 . . . . 2.5899999999999999 111.25 -172.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -89.97 -28.56 19.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.307 -0.406 . . . . 2.7200000000000002 111.14 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 48.6 mt -70.69 -18.49 62.82 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 112.455 0.539 . . . . 2.25 112.455 -173.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.513 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 2.1 p -55.21 -37.21 66.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.095 0.474 . . . . 1.26 111.189 -178.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 28.2 t -61.42 -35.47 77.64 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.599 -0.728 . . . . 1.8 109.983 175.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -80.6 -35.44 34.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.336 -0.847 . . . . 1.8899999999999999 110.616 -177.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.497 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.4 mm? -65.61 -33.12 75.17 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.784 -0.45 . . . . 1.98 109.784 172.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.477 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 57.6 m-70 67.81 42.63 1.91 Allowed 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 108.254 -1.017 . . . . 3.54 108.254 -172.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.664 HG22 ' HE1' ' A' ' 119' ' ' MET . 28.4 mm -53.32 114.95 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 114.039 -1.437 . . . . 1.1499999999999999 111.114 179.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.781 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.76 -168.72 0.21 Allowed Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 107.369 -1.345 . . . . 1.1200000000000001 107.369 -171.504 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.781 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 71.6 Cg_exo -28.96 165.79 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.507 3.471 . . . . 0.53000000000000003 115.183 163.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.61 -26.54 0.0 OUTLIER Glycine 0 N--CA 1.475 1.291 0 N-CA-C 118.258 2.063 . . . . 0.40999999999999998 118.258 -171.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.47 ' N ' ' O ' ' A' ' 76' ' ' PRO . 45.4 p -69.29 6.49 0.99 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.493 1.146 . . . . 1.22 112.125 -179.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.93 -12.48 61.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.286 0.565 . . . . 1.0700000000000001 110.237 173.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -77.52 -19.75 55.3 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.261 -0.644 . . . . 4.3099999999999996 109.261 175.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.44 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 30.3 mt-30 -84.39 -20.8 31.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.867 0.841 . . . . 1.03 109.687 173.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.0 m -74.42 -51.6 14.49 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 114.502 -1.226 . . . . 0.47999999999999998 109.094 170.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.719 ' HA ' HG22 ' A' ' 86' ' ' VAL . 66.6 t80 -66.27 -17.91 65.03 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.991 -1.004 . . . . 1.4399999999999999 110.149 175.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.518 ' HA ' HG11 ' A' ' 87' ' ' VAL . 32.1 tt0 -59.47 -51.31 70.4 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-O 121.624 0.726 . . . . 0.80000000000000004 109.869 178.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.471 ' HG2' ' H ' ' A' ' 85' ' ' GLN . 55.4 mm-40 -48.22 -32.64 7.42 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 113.456 -1.702 . . . . 1.99 110.706 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.719 HG22 ' HA ' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -89.06 -51.36 12.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 113.961 -1.472 . . . . 1.8999999999999999 111.25 -175.413 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.518 HG11 ' HA ' ' A' ' 84' ' ' GLU . 7.9 p -60.96 -22.17 26.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-O 121.824 0.821 . . . . 1.4299999999999999 109.372 -177.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.442 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 5.1 m-80 -77.45 -36.91 52.52 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 113.982 -1.463 . . . . 0.91000000000000003 111.858 175.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.953 ' HB2' ' HB3' ' B' 1009 ' ' ALA . 0.0 OUTLIER -83.91 -17.34 41.08 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 121.951 0.882 . . . . 2.8700000000000001 110.284 179.88 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.651 ' HG ' HH11 ' A' ' 99' ' ' ARG . 0.0 OUTLIER -75.43 -50.74 14.9 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 114.98 -1.009 . . . . 1.9199999999999999 110.525 -179.483 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.428 ' HA ' HG23 ' A' ' 95' ' ' VAL . 4.4 p90 -88.36 -23.71 23.31 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.204 0.816 . . . . 2.9700000000000002 113.204 -166.632 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.654 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -58.19 -39.55 79.24 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.454 0.909 . . . . 5.6699999999999999 113.454 -165.23 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.4 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 8.2 p-10 -110.08 22.94 14.97 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 115.113 1.523 . . . . 3.1200000000000001 115.113 -167.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 134.41 73.63 0.08 OUTLIER Glycine 0 C--N 1.318 -0.462 0 C-N-CA 117.457 -2.306 . . . . 2.3100000000000001 115.303 -176.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.62 HG23 HH21 ' A' ' 99' ' ' ARG . 89.0 t -71.72 102.69 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.79 0.805 . . . . 1.6799999999999999 111.56 178.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -112.01 -174.87 2.55 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.784 -1.098 . . . . 2.1200000000000001 109.531 -179.021 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.591 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 18.7 m-90 -59.8 -60.64 3.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.111 0.481 . . . . 4.1200000000000001 110.643 178.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.549 ' O ' ' HB ' ' A' ' 101' ' ' VAL . . . -66.66 -25.84 72.9 Favored Glycine 0 C--N 1.33 0.211 0 CA-C-N 115.647 -0.706 . . . . 0.80000000000000004 112.544 -176.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.651 HH11 ' HG ' ' A' ' 90' ' ' LEU . 1.1 tmm_? -64.67 -39.87 94.43 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.475 -0.565 . . . . 4.9100000000000001 109.475 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.601 HG21 ' CE2' ' A' ' 104' ' ' PHE . 82.9 mt -69.86 -33.14 54.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.266 -0.425 . . . . 1.1100000000000001 110.406 178.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.549 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 91.6 t -51.46 -57.14 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-N 116.002 -0.545 . . . . 2.0299999999999998 110.44 170.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -47.76 -41.84 24.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.012 -0.994 . . . . 1.0600000000000001 111.52 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.462 ' HB3' ' O ' ' A' ' 100' ' ' ILE . 27.5 t80 -60.29 -43.1 96.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.999 -1.001 . . . . 1.8400000000000001 110.934 178.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.73 ' HA ' ' HE2' ' A' ' 130' ' ' MET . 37.4 m-85 -68.41 -37.64 80.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.325 . . . . 4.21 110.565 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.702 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 16.2 m -61.82 -54.88 36.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.861 -0.609 . . . . 1.55 111.071 -176.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -72.56 -31.04 64.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.823 0.344 . . . . 3.6400000000000001 110.281 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.635 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -66.79 -43.73 90.98 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.87 -0.681 . . . . 0.32000000000000001 111.81 177.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 1.009 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.85 -29.02 73.39 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.686 -0.769 . . . . 0.23999999999999999 111.189 175.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.523 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -72.7 -34.14 66.93 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.402 -0.399 . . . . 1.05 110.244 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.508 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.3 OUTLIER -65.57 -34.64 78.72 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.933 0.873 . . . . 1.78 109.996 -179.072 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.678 ' O ' HG21 ' A' ' 115' ' ' VAL . 43.0 t -51.89 -50.04 61.83 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.268 -1.333 . . . . 0.90000000000000002 109.369 171.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.753 HG11 ' NZ ' ' A' ' 20' ' ' LYS . 97.1 t -64.9 -36.24 77.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 116.268 -0.424 . . . . 1.2 110.527 176.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.513 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 37.5 mt-10 -54.65 -37.63 65.93 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.073 0.463 . . . . 2.5099999999999998 110.341 175.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 21.1 m -78.85 -38.79 37.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.983 -0.553 . . . . 0.28000000000000003 109.995 -178.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.678 HG21 ' O ' ' A' ' 111' ' ' CYS . 93.6 t -68.53 -33.26 59.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.716 0.77 . . . . 1.8300000000000001 109.197 -177.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -55.67 -50.13 71.08 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 113.757 -1.565 . . . . 0.59999999999999998 111.575 -178.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.426 ' HB2' ' HE3' ' A' ' 119' ' ' MET . 29.0 mmtt -87.5 13.48 10.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.932 -0.576 . . . . 2.1600000000000001 110.211 -178.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.574 ' HA ' HE21 ' A' ' 120' ' ' GLN . 20.9 mm-40 63.88 52.02 2.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.821 0.819 . . . . 1.8799999999999999 111.502 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.664 ' HE1' HG22 ' A' ' 74' ' ' ILE . 25.9 mtm -130.64 48.37 2.42 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.751 -1.203 . . . . 1.0800000000000001 107.751 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.574 HE21 ' HA ' ' A' ' 118' ' ' GLU . 4.7 mp0 -64.17 -8.26 11.75 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 114.756 -1.111 . . . . 1.1499999999999999 112.4 -173.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.611 HG23 HD21 ' A' ' 122' ' ' LEU . 28.2 m -64.62 -19.66 25.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.808 0.337 . . . . 1.1899999999999999 111.575 176.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.611 HD21 HG23 ' A' ' 121' ' ' VAL . 3.1 mm? -79.81 -24.29 41.5 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.468 -0.333 . . . . 1.0600000000000001 110.146 178.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.66 HG13 ' SG ' ' A' ' 111' ' ' CYS . 56.7 t -46.93 -56.72 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 O-C-N 123.658 0.599 . . . . 1.0 111.849 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.404 ' OG ' HG12 ' A' ' 30' ' ' VAL . 6.6 t -71.1 -29.84 65.79 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.712 -0.395 . . . . 1.6599999999999999 110.275 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.597 ' HD3' HD12 ' A' ' 122' ' ' LEU . 17.2 mtp180 -65.1 -58.51 5.85 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 116.283 -0.417 . . . . 3.2999999999999998 110.857 178.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.458 HD12 ' HA ' ' A' ' 111' ' ' CYS . 79.2 mt -49.93 -49.9 20.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.58 -0.737 . . . . 1.0600000000000001 110.565 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.658 ' HB2' HD23 ' A' ' 13' ' ' LEU . . . -59.04 -36.49 75.11 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.727 0.299 . . . . 1.1000000000000001 111.528 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.26 -56.69 11.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.504 0.668 . . . . 1.1200000000000001 110.936 177.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.493 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 94.3 m95 -64.47 -35.0 79.53 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.809 -1.087 . . . . 4.7699999999999996 111.182 -176.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.73 ' HE2' ' HA ' ' A' ' 104' ' ' PHE . 1.2 mmm -63.87 -50.5 68.58 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.073 0.463 . . . . 1.0900000000000001 110.824 177.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.531 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -63.48 -34.81 78.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.859 -0.61 . . . . 1.05 110.472 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 69.4 m -64.46 -48.12 76.46 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.165 -0.47 . . . . 1.1299999999999999 110.955 177.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -56.95 -39.56 74.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.814 0.34 . . . . 3.3500000000000001 110.094 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.582 HD11 ' HB2' ' A' ' 5' ' ' ASN . 5.6 tt -60.93 -52.08 66.55 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.702 -0.851 . . . . 1.5900000000000001 108.702 173.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -50.58 -49.09 57.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.742 -0.663 . . . . 0.46000000000000002 112.023 179.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.96 -53.43 6.75 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.028 0.442 . . . . 0.58999999999999997 111.485 -174.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.7 -51.07 5.42 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 112.953 0.723 . . . . 2.3399999999999999 112.953 -169.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 40.6 mt -86.68 -31.57 20.97 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.908 0.707 . . . . 1.8999999999999999 112.908 -163.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.621 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 31.1 tt0 -51.76 -51.95 65.48 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 112.247 0.462 . . . . 0.75 112.247 -173.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.564 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 32.9 Cg_exo -59.48 -46.68 19.79 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 121.621 1.547 . . . . 0.87 111.643 176.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . 0.51 ' CE2' ' HB ' ' A' ' 95' ' ' VAL . 0.5 OUTLIER -53.32 -53.32 52.7 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.658 -0.701 . . . . 1.4299999999999999 110.31 177.787 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.594 HD13 ' HA ' ' A' ' 139' ' ' GLU . 45.5 mt -47.09 -52.79 4.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.446 -0.797 . . . . 1.1299999999999999 111.662 174.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.621 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.3 mm-40 -59.83 -32.01 70.27 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.129 -0.487 . . . . 0.57999999999999996 111.678 -178.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 13.4 mm-40 -64.5 -21.29 66.63 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.482 0.658 . . . . 0.78000000000000003 110.767 177.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -112.68 6.37 18.2 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.212 -0.904 . . . . 0.93000000000000005 110.786 -173.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 118.05 -46.69 1.11 Allowed Glycine 0 N--CA 1.442 -0.928 0 CA-C-N 115.501 -0.772 . . . . 0.56000000000000005 113.099 173.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . 0.542 ' HA2' HG23 ' A' ' 142' ' ' ILE . . . 132.74 -171.68 21.58 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.322 -0.942 . . . . 0.48999999999999999 112.476 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.502 ' NE1' HD12 ' A' ' 142' ' ' ILE . 19.7 m-90 -80.02 -45.92 17.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.96 0.409 . . . . 4.5199999999999996 110.427 -178.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.418 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 18.9 t70 -56.86 -37.88 71.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.412 -0.813 . . . . 1.96 110.018 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.642 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 90.6 m -59.37 -36.65 76.15 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.346 -0.843 . . . . 1.24 111.384 178.468 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.591 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 62.6 t80 -63.63 -35.74 81.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.921 0.391 . . . . 3.7200000000000002 110.493 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.593 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 0.7 OUTLIER -74.51 -25.3 19.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.463 0.649 . . . . 1.8600000000000001 109.67 178.197 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 7.0 mm-40 -70.1 -26.54 64.03 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.736 -0.665 . . . . 1.6699999999999999 109.383 173.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.642 ' HG ' ' O ' ' A' ' 150' ' ' THR . 12.1 mt -83.24 -58.63 2.76 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.545 -0.752 . . . . 1.96 110.338 177.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -114.51 -42.34 3.31 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.597 -0.274 . . . . 4.3899999999999997 110.495 -175.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.545 ' HA2' ' HB1' ' A' ' 49' ' ' ALA . . . 47.54 -156.01 0.94 Allowed Glycine 0 CA--C 1.506 -0.474 0 O-C-N 123.89 0.744 . . . . 1.1000000000000001 114.037 -177.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.697 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 26.3 t-20 -104.41 109.02 20.72 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 114.844 -0.678 . . . . 1.29 110.113 -176.061 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.694 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 19.6 m120 -72.53 -22.41 61.03 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.534 -0.303 . . . . 3.4399999999999999 111.717 -172.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -56.52 -43.57 79.94 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.005 0.431 . . . . 2.6699999999999999 110.135 173.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.453 ' O ' ' HB3' ' A' ' 163' ' ' SER . . . -89.97 -40.0 12.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.133 -0.485 . . . . 2.8700000000000001 111.062 177.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 0.694 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -57.36 -54.09 50.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.194 -0.457 . . . . 3.2000000000000002 111.778 -177.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -66.4 -18.56 65.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.713 0.292 . . . . 3.7200000000000002 111.342 -178.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.453 ' HB3' ' O ' ' A' ' 160' ' ' ALA . 47.7 t -68.67 -30.41 69.08 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.626 -0.509 . . . . 4.2000000000000002 109.626 174.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . 0.521 ' O ' ' HG3' ' A' ' 168' ' ' GLU . 12.2 mpt_? -88.14 -25.21 23.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.26 0.552 . . . . 6.3700000000000001 109.871 176.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -61.95 -36.35 81.16 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.423 -0.808 . . . . 5.0099999999999998 110.127 177.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -63.73 -33.46 87.29 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.643 -0.708 . . . . 5.0999999999999996 112.921 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -89.15 -19.45 25.48 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.862 0.331 . . . . 5.9400000000000004 111.162 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . 0.521 ' HG3' ' O ' ' A' ' 164' ' ' ARG . 41.4 mt-10 -82.6 7.83 13.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.689 0.28 . . . . 5.8799999999999999 110.581 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.508 ' HG3' HD21 ' A' ' 170' ' ' LEU . 21.5 tpp180 -49.91 -52.84 30.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.817 -0.629 . . . . 7.7999999999999998 110.787 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.508 HD21 ' HG3' ' A' ' 169' ' ' ARG . 3.6 mm? -121.86 -27.36 4.66 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.16 -0.473 . . . . 7.29 110.325 177.205 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -77.59 87.66 3.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.242 0.544 . . . . 6.9699999999999998 110.305 178.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -164.81 165.55 20.49 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.588 -0.733 . . . . 9.8100000000000005 109.321 178.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -73.05 127.39 32.43 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.913 0.387 . . . . 11.99 110.421 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 32.7 p80 -128.44 170.08 13.55 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.065 -0.716 . . . . 11.949999999999999 109.065 173.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 78.6 m-70 -78.24 142.52 37.8 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.887 0.375 . . . . 14.949999999999999 110.253 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -130.51 145.93 51.95 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.638 -0.875 . . . . 15.880000000000001 108.638 177.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 67.7 86.14 0.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.473 0.654 . . . . 16.02 109.418 -174.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -168.92 149.65 4.43 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.06 -0.973 . . . . 18.210000000000001 108.823 -176.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -75.02 113.76 12.71 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.237 0.541 . . . . 19.219999999999999 109.892 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -136.36 101.81 4.78 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.568 -0.742 . . . . 22.800000000000001 109.281 178.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . 0.41 ' C ' ' H ' ' A' ' 183' ' ' HIS . 43.2 m80 -71.58 -37.45 71.03 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.649 -0.705 . . . . 22.510000000000002 111.68 -172.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 48.6 t-80 75.09 -37.2 0.34 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.4 0.68 . . . . 25.300000000000001 111.247 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . 0.41 ' H ' ' C ' ' A' ' 181' ' ' HIS . 0.0 OUTLIER -145.76 134.84 22.71 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.426 -0.583 . . . . 25.77 109.426 177.081 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 58.9 m80 -70.53 -45.26 65.88 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.803 0.335 . . . . 27.370000000000001 110.886 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 9.8 p80 . . . . . 0 C--O 1.244 0.799 0 CA-C-O 118.908 -0.568 . . . . 29.52 110.416 178.679 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.074 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B 1002 ' ' GLY . . . . . 0.436 ' C ' ' H1 ' ' B' 1100 ' ' 33B . . . -94.39 69.12 1.3 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.617 -0.801 . . . . 2.9900000000000002 111.638 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.569 ' HA ' ' C2 ' ' B' 1100 ' ' 33B . 3.7 m -107.16 -156.42 0.58 Allowed 'General case' 0 C--N 1.324 -0.542 0 O-C-N 122.545 -0.385 . . . . 1.9399999999999999 110.667 -175.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.674 ' HA ' ' CD2' ' B' 1008 ' ' LEU . 4.9 m 38.94 -98.06 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 124.605 1.191 . . . . 1.9399999999999999 112.873 176.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . -18.37 -45.47 0.01 OUTLIER Glycine 0 CA--C 1.537 1.464 0 N-CA-C 114.63 0.612 . . . . 1.26 114.63 159.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 31.8 mmt180 -105.71 -26.92 11.6 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.371 0.878 . . . . 3.4500000000000002 113.371 178.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -78.68 -61.36 2.04 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.282 0.845 . . . . 1.54 113.282 -165.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.73 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 1.3 mm? -65.31 -44.65 87.2 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.734 -0.839 . . . . 1.8999999999999999 108.734 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 0.953 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . . . -37.25 -52.03 1.05 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.512 -1.222 . . . . 1.45 110.855 169.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.84 ' HB2' ' N11' ' B' 1100 ' ' 33B . . . -76.75 -46.63 24.51 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 113.807 -1.542 . . . . 1.51 111.918 -174.628 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.588 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 30.3 m-85 -68.67 -24.91 64.58 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.36 -0.382 . . . . 2.0699999999999998 111.042 -178.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -72.72 -14.24 78.07 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.966 -0.561 . . . . 0.80000000000000004 112.464 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 13.3 t70 -64.78 -20.26 66.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.345 0.593 . . . . 1.8999999999999999 110.455 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 15.5 m -94.44 35.74 1.19 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.831 -0.622 . . . . 1.4399999999999999 111.889 -177.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1015 ' ' ILE . . . . . . . . . . . . . 5.0 pt -77.77 69.54 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.998 0.428 . . . . 3.4300000000000002 111.745 177.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 10.9 p30 -126.18 175.66 7.62 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 110.171 -0.307 . . . . 4.79 110.171 177.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -90.7 92.9 9.02 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.21 -0.45 . . . . 8.9800000000000004 110.098 178.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.533 0 CA-C-N 116.418 -0.356 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.84 ' N11' ' HB2' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.1 0 CA-C-O 120.948 0.404 . . . . 6.4500000000000002 110.447 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.9 m -69.42 114.67 7.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.255 -0.429 . . . . 2.2599999999999998 110.883 -177.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -63.99 -19.96 65.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.088 0.47 . . . . 2.7599999999999998 110.468 175.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 p -63.4 -23.5 67.43 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.623 -0.717 . . . . 1.54 112.028 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.965 ' HA ' HD23 ' A' ' 8' ' ' LEU . 73.1 m-20 -62.62 -28.18 69.73 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.308 0.575 . . . . 1.78 109.806 176.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.537 ' O ' HG22 ' A' ' 10' ' ' VAL . 7.0 tpp180 -60.64 -48.6 81.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.226 -0.897 . . . . 1.8999999999999999 110.22 177.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.587 ' CD ' ' HG ' ' A' ' 43' ' ' SER . 41.9 mt-10 -56.76 -51.45 68.86 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.392 -0.822 . . . . 0.68000000000000005 111.209 -178.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.965 HD23 ' HA ' ' A' ' 5' ' ' ASN . 0.0 OUTLIER -47.62 -42.68 24.76 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.536 -0.756 . . . . 1.8 110.912 177.531 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.472 HG13 ' HA ' ' A' ' 127' ' ' ALA . 73.1 t -68.88 -63.7 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.46 -0.791 . . . . 1.0700000000000001 110.195 176.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.537 HG22 ' O ' ' A' ' 6' ' ' ARG . 97.7 t -49.31 -53.68 8.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.416 -0.811 . . . . 1.1299999999999999 112.979 -176.277 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -57.81 -34.09 69.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.007 0.432 . . . . 0.58999999999999997 110.598 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.747 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.7 t80 -75.79 -46.52 30.25 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.111 -0.495 . . . . 2.02 110.671 -179.345 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 1.041 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.5 mp -59.87 -42.72 94.33 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 120.787 -0.365 . . . . 1.0600000000000001 110.311 178.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.8 t -60.34 -38.89 85.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.951 -0.568 . . . . 1.6000000000000001 110.47 178.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -71.33 -18.07 62.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.751 -0.659 . . . . 1.49 110.75 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.713 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 10.1 mmpt? -84.86 -46.36 11.4 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 121.368 0.604 . . . . 1.8400000000000001 110.252 -179.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.718 HD23 ' SG ' ' A' ' 111' ' ' CYS . 14.6 mt -55.95 -26.92 50.11 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.125 -0.943 . . . . 1.98 111.276 177.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.6 t -58.55 -35.11 71.81 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.175 -0.921 . . . . 1.3799999999999999 112.522 176.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.713 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 27.8 pt20 -80.43 -7.94 59.34 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.989 0.737 . . . . 1.51 112.989 -170.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.771 ' NZ ' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -111.93 -20.14 12.12 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 122.164 0.983 . . . . 2.6499999999999999 109.238 178.545 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.09 28.1 6.29 Favored Glycine 0 C--N 1.306 -1.134 0 CA-C-N 113.652 -1.613 . . . . 0.54000000000000004 112.741 174.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.527 ' HD1' ' HE3' ' A' ' 20' ' ' LYS . 70.8 m-85 -110.17 166.25 11.11 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.716 0.293 . . . . 1.1200000000000001 110.83 172.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.508 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 4.0 t -110.62 154.98 23.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.341 -0.391 . . . . 0.75 110.554 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.65 ' HZ2' HG23 ' A' ' 30' ' ' VAL . 68.0 t-105 -72.64 -54.5 8.88 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.101 -0.5 . . . . 4.29 110.252 174.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.4 t -62.38 -27.52 69.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.699 -0.682 . . . . 1.8600000000000001 111.776 -173.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.508 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 95.3 mt-30 -59.26 -26.6 65.06 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 111.898 0.333 . . . . 1.52 111.898 178.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -119.94 -10.73 9.42 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.086 0.402 . . . . 1.53 112.086 -173.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.54 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 49.3 m -101.89 179.53 4.3 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 113.627 0.973 . . . . 2.04 113.627 -169.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.413 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 0.8 OUTLIER -156.08 -14.26 0.1 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.376 -1.284 . . . . 2.3100000000000001 110.015 -179.015 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.676 HG21 ' HG3' ' A' ' 31' ' ' GLU . 12.3 m -51.95 -71.56 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.479 -1.237 . . . . 1.4099999999999999 112.76 -169.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.676 ' HG3' HG21 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -99.9 1.22 42.61 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-O 121.54 0.686 . . . . 2.7400000000000002 109.672 177.844 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.413 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.5 tt0 -67.36 -56.03 11.36 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.697 -1.138 . . . . 1.45 111.157 -178.521 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -98.33 -51.67 3.9 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.9 -0.591 . . . . 1.8700000000000001 111.518 -172.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 28.9 ptt-85 -92.77 160.99 14.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.002 0.43 . . . . 3.8199999999999998 111.223 -176.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.3 p -113.07 114.1 26.37 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.507 0.67 . . . . 2.6699999999999999 111.252 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -122.22 -66.67 1.01 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.161 -0.927 . . . . 3.3399999999999999 109.832 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -97.64 148.83 35.01 Favored Pre-proline 0 C--N 1.318 -0.776 0 CA-C-N 115.24 -0.891 . . . . 2.4399999999999999 110.474 176.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.715 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 35.2 Cg_exo -62.0 -176.83 0.23 Allowed 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 123.13 2.553 . . . . 1.8700000000000001 112.258 175.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -81.43 -4.76 56.75 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.483 0.658 . . . . 4.6399999999999997 110.449 177.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 154.5 69.63 0.01 OUTLIER Glycine 0 N--CA 1.441 -0.971 0 CA-C-N 115.338 -0.846 . . . . 2.3999999999999999 111.168 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.768 HG21 ' H ' ' A' ' 42' ' ' GLU . 0.6 OUTLIER -69.61 -76.43 0.1 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.89 0.376 . . . . 1.45 110.46 -176.63 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.768 ' H ' HG21 ' A' ' 41' ' ' THR . 15.4 pt-20 -93.53 -27.82 16.42 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-O 123.176 1.465 . . . . 2.02 107.908 166.428 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.587 ' HG ' ' CD ' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -66.83 -20.92 66.03 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 111.676 -2.511 . . . . 1.25 113.954 -167.577 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 35.5 tt0 -54.89 -59.84 4.18 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.933 -0.307 . . . . 1.9099999999999999 111.012 -179.201 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.503 ' HB2' HG23 ' A' ' 152' ' ' VAL . . . -64.58 -36.35 83.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.223 0.535 . . . . 1.1799999999999999 110.034 179.195 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.542 ' HA ' ' CG1' ' A' ' 152' ' ' VAL . 99.4 t -59.5 -60.74 2.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 114.917 -1.038 . . . . 2.0099999999999998 111.14 178.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.474 ' HB3' HD12 ' A' ' 8' ' ' LEU . 11.2 ptpt -62.42 -35.13 78.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.624 0.726 . . . . 1.3799999999999999 109.255 -176.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.645 ' NE2' ' HD3' ' A' ' 51' ' ' ARG . 7.1 mm100 -65.95 -32.31 73.73 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.941 -1.027 . . . . 0.98999999999999999 110.826 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.668 ' HB3' ' HA2' ' A' ' 156' ' ' GLY . . . -74.5 -43.88 53.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.13 0.49 . . . . 1.1399999999999999 110.624 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.475 ' O ' ' HE2' ' A' ' 12' ' ' PHE . 8.0 mp -63.25 -26.54 68.83 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.429 -0.805 . . . . 1.95 112.88 -174.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.645 ' HD3' ' NE2' ' A' ' 48' ' ' GLN . 10.4 ptm180 -78.51 -32.41 48.09 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.156 -1.053 . . . . 2.5099999999999998 108.156 -175.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 3.7 mm-40 -80.41 -44.19 19.75 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 113.565 -1.652 . . . . 1.1000000000000001 109.907 -179.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.29 -41.08 98.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.486 -0.779 . . . . 1.04 110.169 175.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.725 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.16 -42.23 98.49 Favored Glycine 0 C--O 1.22 -0.759 0 CA-C-N 115.558 -0.746 . . . . 0.69999999999999996 112.001 177.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.599 ' O ' HD21 ' A' ' 59' ' ' LEU . 29.8 t70 -53.46 -37.78 62.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.948 0.404 . . . . 1.04 111.296 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -71.93 -24.92 61.71 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.729 -0.669 . . . . 2.29 111.863 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -84.01 -44.62 13.96 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 112.103 0.408 . . . . 2.9300000000000002 112.103 174.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.725 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.3 mt-10 -66.02 -46.27 78.48 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.111 0.782 . . . . 1.3 113.111 -164.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.599 HD21 ' O ' ' A' ' 55' ' ' ASP . 2.5 pt? -53.46 -31.22 44.62 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.014 -0.539 . . . . 2.1899999999999999 111.347 -173.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 67.2 mtt-85 -64.93 -53.71 42.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.549 -0.75 . . . . 3.1400000000000001 111.741 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.723 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 15.3 p90 -90.76 -3.8 57.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.595 -0.275 . . . . 5.5899999999999999 111.119 -176.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.4 ttt180 -53.59 -34.87 59.93 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.469 0.544 . . . . 4.9299999999999997 112.469 -172.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -64.77 -33.88 77.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.992 0.425 . . . . 5.3499999999999996 110.761 177.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.545 ' HB3' ' CD1' ' A' ' 68' ' ' LEU . . . -78.37 -28.91 47.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.891 -0.595 . . . . 1.7 110.577 -178.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.564 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 52.7 t80 -44.3 -46.91 9.42 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.543 0.572 . . . . 3.52 112.543 -176.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 36.7 t -62.76 -44.68 95.55 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.894 0.378 . . . . 2.5899999999999999 110.744 -177.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.75 -29.12 40.43 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.104 -0.498 . . . . 2.7200000000000002 111.549 -176.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.736 ' HA ' ' HG3' ' A' ' 71' ' ' GLN . 4.1 mp -61.6 -24.37 66.64 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.677 0.621 . . . . 2.25 112.677 -175.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.453 HG22 HG13 ' A' ' 74' ' ' ILE . 21.2 p -57.73 -29.13 64.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.171 0.51 . . . . 1.26 110.719 178.479 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.5 t -76.8 -38.87 53.17 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.566 -0.743 . . . . 1.8 109.768 176.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.736 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 6.5 mt-30 -65.63 -47.17 76.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.32 -0.854 . . . . 1.8899999999999999 110.161 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.62 HD12 ' HZ ' ' A' ' 106' ' ' PHE . 1.2 mt -74.8 -31.4 61.72 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.753 -0.658 . . . . 1.98 110.545 178.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.468 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 49.2 m80 71.86 54.64 0.19 Allowed 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.563 0.697 . . . . 3.54 109.276 -176.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.516 HG23 ' HE2' ' A' ' 119' ' ' MET . 15.2 mm -58.58 118.47 2.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 114.165 -1.379 . . . . 1.1499999999999999 110.666 -179.732 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.763 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -156.39 -170.41 0.24 Allowed Pre-proline 0 CA--C 1.546 0.827 0 N-CA-C 107.98 -1.118 . . . . 1.1200000000000001 107.98 -169.214 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.763 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 38.4 Cg_exo -29.47 166.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.278 0 C-N-CA 124.814 3.676 . . . . 0.53000000000000003 115.091 163.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -33.24 -24.08 0.01 OUTLIER Glycine 0 N--CA 1.471 1.0 0 N-CA-C 117.259 1.664 . . . . 0.40999999999999998 117.259 -174.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.453 ' N ' ' O ' ' A' ' 76' ' ' PRO . 17.2 p -71.96 6.3 2.17 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 117.994 0.897 . . . . 1.22 112.216 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.57 -12.64 61.56 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.165 0.507 . . . . 1.0700000000000001 110.19 174.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.436 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 1.8 p90 -76.0 -15.13 60.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.013 -0.539 . . . . 4.3099999999999996 109.841 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.446 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 36.3 mt-30 -83.38 -26.31 30.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.451 -0.795 . . . . 1.03 109.793 173.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.517 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.2 m -74.48 -50.12 19.56 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.041 -0.981 . . . . 0.47999999999999998 109.392 172.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.702 ' HA ' HG23 ' A' ' 86' ' ' VAL . 59.1 t80 -65.54 -18.29 65.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.991 -1.004 . . . . 1.4399999999999999 110.06 175.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.566 ' HA ' HG12 ' A' ' 87' ' ' VAL . 37.9 tt0 -62.84 -49.02 76.54 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.258 -0.883 . . . . 0.80000000000000004 110.57 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -48.1 -36.43 13.2 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.716 -1.129 . . . . 1.99 110.125 177.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.775 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.0 OUTLIER -81.37 -54.58 9.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 114.452 -1.249 . . . . 1.8999999999999999 111.026 -176.108 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.566 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.6 p -59.33 -23.45 25.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 122.038 0.923 . . . . 1.4299999999999999 109.396 -177.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.432 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.7 m-80 -71.31 -58.46 3.51 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 113.945 -1.48 . . . . 0.91000000000000003 110.894 172.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 1.045 ' HB2' ' HB1' ' B' 1009 ' ' ALA . 0.0 OUTLIER -62.26 -38.8 90.69 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-O 121.967 0.889 . . . . 2.8700000000000001 109.358 -174.396 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.571 ' HB2' ' O ' ' A' ' 86' ' ' VAL . 1.7 tp -56.12 -30.55 62.25 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 113.194 -1.821 . . . . 1.9199999999999999 110.912 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.552 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 71.6 t80 -94.35 -33.38 13.2 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.488 -0.324 . . . . 2.9700000000000002 111.839 -168.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.91 -45.99 47.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 122.119 0.961 . . . . 5.6699999999999999 110.213 -175.286 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -95.82 20.63 9.61 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 113.803 -1.544 . . . . 3.1200000000000001 112.568 -159.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.474 ' O ' ' HG2' ' A' ' 99' ' ' ARG . . . 130.16 68.56 0.11 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 118.141 -1.981 . . . . 2.3100000000000001 115.757 174.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.645 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 61.2 t -73.04 98.71 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 118.593 1.196 . . . . 1.6799999999999999 110.23 173.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.593 ' ND2' ' HB3' ' A' ' 99' ' ' ARG . 3.3 p30 -111.98 -174.46 2.47 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.537 -1.21 . . . . 2.1200000000000001 109.24 175.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.631 ' HA ' ' CE2' ' A' ' 151' ' ' PHE . 16.1 m-90 -61.68 -45.62 93.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.979 -0.555 . . . . 4.1200000000000001 110.856 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.437 ' C ' HG12 ' B' 1015 ' ' ILE . . . -77.43 -37.0 32.46 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.905 -0.589 . . . . 0.80000000000000004 113.456 -174.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.662 ' NH2' HD11 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -64.83 -29.14 70.09 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 122.433 -0.451 . . . . 4.9100000000000001 110.524 -177.168 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.56 HG22 ' HE1' ' A' ' 104' ' ' PHE . 45.4 mt -68.58 -36.91 76.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 C-N-CA 120.231 -0.587 . . . . 1.1100000000000001 110.314 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.416 HG13 ' O ' ' A' ' 98' ' ' GLY . 0.6 OUTLIER -59.46 -31.46 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 109.562 -0.532 . . . . 2.0299999999999998 109.562 175.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -65.74 -35.36 80.5 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.837 -0.62 . . . . 1.0600000000000001 111.06 179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.454 ' HB3' ' O ' ' A' ' 100' ' ' ILE . 17.4 t80 -60.95 -32.78 72.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.114 -0.948 . . . . 1.8400000000000001 109.95 177.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.56 ' HE1' HG22 ' A' ' 100' ' ' ILE . 89.1 m-85 -80.27 -35.94 35.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.945 -0.57 . . . . 4.21 110.4 175.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.747 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 20.0 m -61.44 -53.58 54.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.082 -0.508 . . . . 1.55 110.658 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.62 ' HZ ' HD12 ' A' ' 72' ' ' LEU . 32.2 t80 -73.46 -33.61 64.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.06 -0.518 . . . . 3.6400000000000001 110.392 -178.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.471 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -67.93 -44.83 77.29 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.974 -0.631 . . . . 0.32000000000000001 111.835 178.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 1.041 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.22 -31.67 81.37 Favored Glycine 0 N--CA 1.442 -0.914 0 N-CA-C 111.097 -0.801 . . . . 0.23999999999999999 111.097 175.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.564 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -68.52 -34.77 76.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.304 -0.448 . . . . 1.05 109.887 176.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.445 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.2 OUTLIER -64.2 -35.63 81.44 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.909 0.861 . . . . 1.78 110.169 -178.52 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.718 ' SG ' HD23 ' A' ' 17' ' ' LEU . 41.4 t -52.55 -49.16 65.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.51 -1.223 . . . . 0.90000000000000002 109.478 172.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.771 HG13 ' NZ ' ' A' ' 20' ' ' LYS . 94.5 t -64.59 -37.15 79.32 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 CA-C-N 116.272 -0.422 . . . . 1.2 110.557 175.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.477 ' HB3' HG21 ' A' ' 74' ' ' ILE . 46.5 mt-10 -56.44 -34.85 67.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.96 0.41 . . . . 2.5099999999999998 110.965 176.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.406 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 26.6 m -79.34 -36.75 38.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.366 0.603 . . . . 0.28000000000000003 109.715 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.679 HG22 ' O ' ' A' ' 111' ' ' CYS . 98.1 t -69.34 -32.19 52.46 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.993 0.902 . . . . 1.8300000000000001 109.427 -178.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -56.83 -50.05 73.56 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.596 -1.638 . . . . 0.59999999999999998 111.302 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.437 ' CG ' ' HE1' ' A' ' 119' ' ' MET . 35.9 mmtt -85.87 13.8 6.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.795 -0.639 . . . . 2.1600000000000001 110.608 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 62.16 48.45 4.97 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.626 0.727 . . . . 1.8799999999999999 110.497 -178.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.516 ' HE2' HG23 ' A' ' 74' ' ' ILE . 31.4 mtm -126.67 44.09 2.96 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.909 -1.145 . . . . 1.0800000000000001 107.909 -178.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.602 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 12.4 mp0 -61.75 -6.99 2.99 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.927 -1.033 . . . . 1.1499999999999999 113.31 -171.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.513 HG23 HD21 ' A' ' 122' ' ' LEU . 34.2 m -65.55 -25.32 36.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 120.771 0.32 . . . . 1.1899999999999999 111.029 176.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.611 HD11 ' HD2' ' A' ' 125' ' ' ARG . 2.9 mm? -73.89 -25.3 59.95 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 116.563 -0.289 . . . . 1.0600000000000001 110.556 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.713 HG13 ' SG ' ' A' ' 111' ' ' CYS . 53.2 t -44.13 -53.12 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 O-C-N 123.63 0.581 . . . . 1.0 112.211 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.54 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 6.4 t -78.32 -22.2 48.48 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.097 0.475 . . . . 1.6599999999999999 110.687 -177.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.611 ' HD2' HD11 ' A' ' 122' ' ' LEU . 75.1 mtt180 -79.33 -44.87 20.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.093 -0.503 . . . . 3.2999999999999998 110.897 -177.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.672 ' HA ' ' CE3' ' A' ' 129' ' ' TRP . 85.6 mt -56.15 -47.46 80.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.838 -0.619 . . . . 1.0600000000000001 110.781 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.538 ' HB3' ' HH2' ' A' ' 24' ' ' TRP . . . -59.2 -35.95 74.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.818 0.342 . . . . 1.1000000000000001 111.024 178.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.428 ' HB1' ' O ' ' A' ' 125' ' ' ARG . . . -58.1 -58.72 7.17 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.58 0.705 . . . . 1.1200000000000001 110.383 175.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.672 ' CE3' ' HA ' ' A' ' 126' ' ' ILE . 16.6 m0 -56.12 -48.46 76.16 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.22 -1.354 . . . . 4.7699999999999996 110.32 -178.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.534 ' SD ' HG22 ' A' ' 126' ' ' ILE . 91.3 mtp -59.06 -55.02 40.49 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.658 -0.701 . . . . 1.0900000000000001 111.787 -176.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.22 -38.66 87.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.137 -0.483 . . . . 1.05 111.42 -177.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 47.8 m -65.66 -47.21 76.28 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.73 -0.388 . . . . 1.1299999999999999 110.7 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.645 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 5.5 m-85 -56.36 -36.06 68.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.3 -0.409 . . . . 3.3500000000000001 110.529 177.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.838 HD12 ' HZ2' ' A' ' 148' ' ' TRP . 4.2 tt -62.28 -58.38 7.92 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.786 -0.82 . . . . 1.5900000000000001 108.786 170.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -48.38 -45.66 36.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.338 -0.846 . . . . 0.46000000000000002 112.842 -176.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -88.96 -45.81 9.38 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.056 0.391 . . . . 0.58999999999999997 112.056 -175.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . 0.645 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 31.0 m-70 -91.25 -48.98 6.62 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.414 0.524 . . . . 2.3399999999999999 112.414 -170.15 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.747 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -88.52 -44.24 10.82 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 113.819 1.044 . . . . 1.8999999999999999 113.819 -168.603 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.647 ' HA ' HD13 ' A' ' 142' ' ' ILE . 34.8 tt0 -43.44 -53.15 12.09 Favored Pre-proline 0 C--N 1.323 -0.566 0 O-C-N 123.831 0.707 . . . . 0.75 112.8 -174.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.63 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 10.8 Cg_endo -54.37 -49.44 16.92 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 121.857 1.705 . . . . 0.87 111.574 177.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 5.0 t-105 -55.99 -52.99 62.22 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.556 -0.747 . . . . 1.4299999999999999 110.341 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.647 HD13 ' HA ' ' A' ' 139' ' ' GLU . 43.6 mt -46.55 -52.29 3.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.804 -0.634 . . . . 1.1299999999999999 111.812 176.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.611 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.8 mm-40 -60.25 -32.09 70.82 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.766 -0.652 . . . . 0.57999999999999996 111.782 -179.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.63 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.6 mm-40 -65.44 -21.43 66.65 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 121.659 0.742 . . . . 0.78000000000000003 110.464 177.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -107.87 9.57 28.77 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.019 -0.991 . . . . 0.93000000000000005 110.016 -174.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 121.46 -29.37 5.7 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.902 -1.045 . . . . 0.56000000000000005 113.38 171.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 108.64 166.11 20.89 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.649 -0.786 . . . . 0.48999999999999999 111.227 -175.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.838 ' HZ2' HD12 ' A' ' 134' ' ' LEU . 16.9 m95 -57.16 -40.39 77.15 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.82 0.674 . . . . 4.5199999999999996 112.82 -174.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.516 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 9.9 m-20 -55.35 -41.61 72.76 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.303 -0.258 . . . . 1.96 110.303 177.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.594 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 23.4 m -56.58 -38.55 72.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.234 -0.439 . . . . 1.24 111.508 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.631 ' CE2' ' HA ' ' A' ' 97' ' ' TRP . 1.2 m-85 -61.29 -36.77 81.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.543 0.687 . . . . 3.7200000000000002 109.44 -178.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.542 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 0.7 OUTLIER -80.32 -25.41 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 115.382 -0.827 . . . . 1.8600000000000001 110.042 178.115 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 6.6 mm-40 -64.56 -29.73 70.75 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.135 0.493 . . . . 1.6699999999999999 109.902 173.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 150' ' ' THR . 9.5 mt -82.96 -56.44 3.81 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.633 -0.712 . . . . 1.96 110.164 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . 0.409 ' HE2' ' HB2' ' A' ' 52' ' ' GLU . 62.5 t80 -113.48 -44.93 3.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.296 -0.411 . . . . 4.3899999999999997 110.752 -176.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.668 ' HA2' ' HB3' ' A' ' 49' ' ' ALA . . . 43.36 -157.15 0.12 Allowed Glycine 0 CA--C 1.502 -0.746 0 CA-C-O 121.769 0.65 . . . . 1.1000000000000001 113.829 -177.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.607 ' ND2' HE21 ' A' ' 48' ' ' GLN . 27.4 t-20 -112.02 108.2 17.43 Favored 'General case' 0 N--CA 1.426 -1.636 0 CA-C-N 114.776 -0.712 . . . . 1.29 109.745 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.683 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 8.9 m120 -74.72 -25.11 58.9 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.081 -0.508 . . . . 3.4399999999999999 111.421 -175.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -56.43 -35.68 68.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.07 0.462 . . . . 2.6699999999999999 110.541 176.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -87.62 -39.63 14.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.041 -0.527 . . . . 2.8700000000000001 110.481 174.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 0.599 ' HB2' ' HA ' ' A' ' 158' ' ' ASN . . . -53.7 -63.27 1.2 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.713 -0.676 . . . . 3.2000000000000002 111.894 -177.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.683 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 11.1 pt-20 -66.11 -22.47 66.4 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 120.989 -0.284 . . . . 3.7200000000000002 111.529 -177.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 44.3 t -64.44 -46.95 80.95 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.804 -0.443 . . . . 4.2000000000000002 109.804 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 11.1 mpt_? -84.55 -13.46 51.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.36 0.6 . . . . 6.3700000000000001 110.371 179.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.606 ' HB3' ' HA ' ' A' ' 162' ' ' GLU . 39.5 ttmt -82.64 -25.58 32.99 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.432 -0.804 . . . . 5.0099999999999998 110.478 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -61.64 -38.04 95.21 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.796 -0.638 . . . . 5.0999999999999996 112.575 -177.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -75.75 -20.69 58.11 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.948 0.404 . . . . 5.9400000000000004 110.709 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -80.46 -2.78 47.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.157 -0.474 . . . . 5.8799999999999999 110.122 176.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.429 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 3.9 tmt_? -73.45 -36.14 65.85 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.537 -0.912 . . . . 7.7999999999999998 108.537 176.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -76.9 -26.0 53.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.505 -0.77 . . . . 7.29 109.558 176.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -86.19 -175.84 5.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.415 -0.811 . . . . 6.9699999999999998 109.235 174.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 35.2 t60 -139.21 88.55 2.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.147 0.498 . . . . 9.8100000000000005 109.916 173.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -103.58 141.86 35.29 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.146 -0.687 . . . . 11.99 109.146 178.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 72.86 136.8 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.981 0.801 . . . . 11.949999999999999 110.449 -178.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -109.66 131.43 55.07 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.101 0.476 . . . . 14.949999999999999 110.998 -177.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 16.6 t60 -102.61 105.15 15.6 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.882 -0.784 . . . . 15.880000000000001 108.882 174.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 22.7 p80 -80.24 139.21 36.8 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.962 0.41 . . . . 16.02 110.635 -177.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 42.3 mt -82.94 166.73 18.63 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.878 -0.786 . . . . 18.210000000000001 108.878 175.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 66.71 112.63 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 O-C-N 123.678 0.611 . . . . 19.219999999999999 111.042 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 28.4 m-70 -83.81 -171.8 3.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.976 -0.557 . . . . 22.800000000000001 110.138 177.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -115.04 158.29 22.32 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.282 -0.417 . . . . 22.510000000000002 110.035 178.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -85.31 -42.87 14.22 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.854 -0.424 . . . . 25.300000000000001 109.854 -178.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -77.31 119.12 20.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.953 -0.567 . . . . 25.77 109.725 175.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -107.41 130.72 54.78 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.453 -0.573 . . . . 27.370000000000001 109.453 178.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 80.9 t60 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.764 -0.636 . . . . 29.52 110.338 -178.761 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.255 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -103.61 -143.58 12.85 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.941 -0.647 . . . . 2.9900000000000002 112.039 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.531 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . 59.7 m 61.39 -158.71 0.33 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.618 0.247 . . . . 1.9399999999999999 110.514 -179.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B 1004 ' ' VAL . . . . . . . . . . . . . 22.8 m 63.05 -20.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 N-CA-C 116.461 2.023 . . . . 1.9399999999999999 116.461 162.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 0.945 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . -94.42 5.25 70.64 Favored Glycine 0 N--CA 1.439 -1.165 0 C-N-CA 119.925 -1.131 . . . . 1.26 110.366 153.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B 1006 ' ' ARG . . . . . 0.433 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 7.4 mpt_? -121.46 -32.29 3.87 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.952 0.501 . . . . 3.4500000000000002 111.878 174.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B 1007 ' ' ALA . . . . . 0.568 ' HB1' ' O2 ' ' B' 1100 ' ' 33B . . . -82.26 -54.14 5.48 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.256 -0.429 . . . . 1.54 112.114 -167.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.501 ' H ' HD22 ' B' 1008 ' ' LEU . 2.2 mm? -70.03 -31.69 69.45 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.076 -0.713 . . . . 1.8999999999999999 109.076 -177.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 1.045 ' HB1' ' HB2' ' A' ' 89' ' ' GLU . . . -49.89 -45.34 50.66 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.367 -1.288 . . . . 1.45 109.782 172.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.898 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -85.23 -49.41 8.22 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 113.178 -1.828 . . . . 1.51 111.498 -174.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.618 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 49.7 m-85 -65.58 -23.56 66.87 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.048 -0.524 . . . . 2.0699999999999998 110.498 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.82 -11.35 83.52 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.932 -0.576 . . . . 0.80000000000000004 112.934 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 32.6 t70 -71.84 -15.43 62.13 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.5 0.667 . . . . 1.8999999999999999 109.654 170.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 32.6 m -111.35 82.27 1.58 Allowed 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.553 -0.749 . . . . 1.4399999999999999 110.223 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.602 ' H ' HD13 ' B' 1015 ' ' ILE . 0.8 OUTLIER -95.28 -96.01 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 108.521 -0.918 . . . . 3.4300000000000002 108.521 175.903 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -84.02 -7.7 59.33 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.732 -0.84 . . . . 4.79 108.732 170.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 72.8 mtp180 -96.89 86.78 4.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.844 -1.071 . . . . 8.9800000000000004 110.169 -179.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.694 0 CA-C-N 116.524 -0.307 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.898 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.9 ptp . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 109.992 -0.373 . . . . 6.4500000000000002 109.992 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.0 m -67.11 -35.3 79.47 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.108 0.48 . . . . 2.2599999999999998 110.953 -178.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.703 ' HB3' ' HB3' ' A' ' 36' ' ' GLU . 26.3 mp0 -64.77 -10.65 29.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.968 -0.56 . . . . 2.7599999999999998 111.072 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m -82.13 -17.92 44.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.167 -0.469 . . . . 1.54 111.068 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.751 ' HB3' ' CD2' ' A' ' 134' ' ' LEU . 76.2 m-20 -62.64 -22.1 66.18 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 121.218 0.532 . . . . 1.78 109.756 177.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.59 ' HA ' ' HB1' ' A' ' 131' ' ' ALA . 11.7 tpp85 -57.78 -43.53 85.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.276 -0.875 . . . . 1.8999999999999999 110.573 176.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -61.58 -49.16 77.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.71 -0.677 . . . . 0.68000000000000005 111.242 -177.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.738 HD21 ' HA ' ' A' ' 5' ' ' ASN . 0.3 OUTLIER -50.04 -32.99 16.83 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.129 -0.942 . . . . 1.8 111.383 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.413 HG13 ' HA ' ' A' ' 127' ' ' ALA . 79.5 t -79.53 -62.25 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.79 -0.641 . . . . 1.0700000000000001 110.24 173.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.521 HG11 ' CE2' ' A' ' 24' ' ' TRP . 73.2 t -48.58 -54.73 4.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.504 -0.771 . . . . 1.1299999999999999 112.553 -176.159 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -57.08 -37.49 71.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.094 -0.503 . . . . 0.58999999999999997 110.524 -177.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.737 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 19.2 t80 -69.8 -46.49 65.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.939 -0.573 . . . . 2.02 110.501 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 1.055 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.9 mp -62.01 -39.48 92.39 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 120.98 -0.288 . . . . 1.0600000000000001 110.45 178.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.3 m -58.63 -42.21 87.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.395 0.617 . . . . 1.6000000000000001 110.205 176.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -67.47 -17.84 64.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.108 -0.951 . . . . 1.49 111.108 -178.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.611 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.4 mmpt? -85.96 -49.1 8.1 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.525 0.679 . . . . 1.8400000000000001 109.777 -178.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.58 HD21 ' SG ' ' A' ' 111' ' ' CYS . 12.4 mt -59.33 -28.31 66.7 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.965 -1.016 . . . . 1.98 111.26 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.3 t -56.82 -43.88 81.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.427 -0.806 . . . . 1.3799999999999999 111.678 177.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 12.4 pt20 -80.64 2.02 27.53 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.995 0.426 . . . . 1.51 111.587 -178.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.716 ' HE2' HG12 ' A' ' 112' ' ' VAL . 20.7 mmmt -107.39 -28.54 9.79 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.913 0.863 . . . . 2.6499999999999999 109.032 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 22.25 10.4 Favored Glycine 0 N--CA 1.441 -0.999 0 CA-C-N 113.888 -1.505 . . . . 0.54000000000000004 111.576 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -113.61 161.73 17.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.862 0.363 . . . . 1.1200000000000001 110.691 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.3 t -102.33 145.94 28.75 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.998 -0.546 . . . . 0.75 110.259 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.735 ' HZ2' HG23 ' A' ' 30' ' ' VAL . 48.2 t-105 -75.09 -51.77 12.68 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.598 -0.728 . . . . 4.29 109.192 174.471 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.8 m -60.01 -34.48 73.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.378 -0.828 . . . . 1.8600000000000001 111.976 -174.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -61.45 -28.78 69.52 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.781 0.325 . . . . 1.52 111.536 -179.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -120.85 19.06 11.8 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.192 -0.458 . . . . 1.53 111.253 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.533 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 53.7 p -99.81 -178.72 3.95 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.592 0.71 . . . . 2.04 112.034 -172.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.524 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.0 OUTLIER -165.43 -25.69 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.429 -1.26 . . . . 2.3100000000000001 109.304 -179.364 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.735 HG23 ' HZ2' ' A' ' 24' ' ' TRP . 10.7 m -50.63 -71.89 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 114.387 -1.279 . . . . 1.4099999999999999 112.864 -173.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.658 ' H ' HG21 ' A' ' 30' ' ' VAL . 9.0 pt-20 -94.82 0.38 54.82 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.929 -0.767 . . . . 2.7400000000000002 108.929 177.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.524 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 30.5 tt0 -70.61 -53.46 15.84 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.671 -1.15 . . . . 1.45 110.577 -178.008 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -97.21 -37.42 10.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.867 -0.606 . . . . 1.8700000000000001 111.402 -175.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.408 ' O ' ' HA ' ' A' ' 31' ' ' GLU . 25.1 ptt180 -124.17 144.81 49.7 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.077 0.465 . . . . 3.8199999999999998 111.185 179.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.2 p -116.76 111.93 20.45 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.51 0.672 . . . . 2.6699999999999999 110.695 178.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.703 ' HB3' ' HB3' ' A' ' 3' ' ' GLN . 8.9 mm-40 -85.81 -71.75 0.52 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.349 -0.841 . . . . 3.3399999999999999 110.7 -177.092 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.439 ' HB3' ' HD2' ' A' ' 38' ' ' PRO . . . -100.06 170.84 6.2 Favored Pre-proline 0 C--N 1.319 -0.75 0 CA-C-N 115.811 -0.631 . . . . 2.4399999999999999 110.194 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.582 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 75.7 Cg_exo -53.21 170.4 0.34 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.881 2.388 . . . . 1.8700000000000001 111.695 170.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -72.44 0.62 9.75 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 122.186 -0.321 . . . . 4.6399999999999997 111.01 -179.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.42 ' HA2' ' OG ' ' A' ' 43' ' ' SER . . . 159.02 70.15 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.801 0 CA-C-N 115.901 -0.591 . . . . 2.3999999999999999 111.734 176.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.624 HG22 ' H ' ' A' ' 42' ' ' GLU . 0.5 OUTLIER -74.57 -73.06 0.25 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 120.754 -0.378 . . . . 1.45 110.757 -177.894 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.624 ' H ' HG22 ' A' ' 41' ' ' THR . 0.0 OUTLIER -91.85 -35.36 14.12 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 121.717 0.77 . . . . 2.02 109.486 172.883 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.737 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 27.9 p -54.42 -36.96 64.55 Favored 'General case' 0 C--O 1.212 -0.886 0 CA-C-N 114.19 -1.368 . . . . 1.25 113.122 -171.044 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -42.6 -40.49 2.71 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.694 0.627 . . . . 1.9099999999999999 112.694 -171.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.529 ' HB1' HG23 ' A' ' 152' ' ' VAL . . . -87.51 -36.18 17.78 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 121.926 -0.484 . . . . 1.1799999999999999 111.543 178.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.665 HG13 ' HA ' ' A' ' 43' ' ' SER . 0.7 OUTLIER -72.63 -37.07 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.894 -0.139 . . . . 2.0099999999999998 111.18 -177.801 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.737 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.8 ptpt -67.15 -40.22 86.66 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.018 -0.734 . . . . 1.3799999999999999 109.018 175.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.591 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 5.9 mm100 -63.28 -34.62 78.07 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.317 -0.856 . . . . 0.98999999999999999 110.953 176.118 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.472 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -72.67 -38.21 67.67 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.192 0.52 . . . . 1.1399999999999999 110.841 178.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 mp -69.96 -23.88 63.25 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.624 -0.716 . . . . 1.95 112.508 -174.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.588 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 9.3 ptp180 -84.92 -25.49 27.87 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.95 0.881 . . . . 2.5099999999999998 109.054 -175.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 10.7 mm-40 -78.05 -45.34 23.86 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.233 -1.349 . . . . 1.1000000000000001 110.202 176.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.03 -40.57 91.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.005 -0.543 . . . . 1.04 110.129 174.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.723 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.35 -41.0 98.27 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.778 -0.646 . . . . 0.69999999999999996 112.03 178.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.481 ' O ' HD21 ' A' ' 59' ' ' LEU . 19.6 t70 -55.09 -35.31 64.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.984 0.421 . . . . 1.04 110.767 -179.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.419 ' O ' HD22 ' A' ' 59' ' ' LEU . 29.4 mm-40 -73.3 -25.96 60.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.337 -0.847 . . . . 2.29 111.898 179.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.433 ' HE1' ' HA2' ' B' 1012 ' ' GLY . 66.2 t80 -83.51 -33.31 25.56 Favored 'General case' 0 C--N 1.316 -0.858 0 O-C-N 122.205 -0.309 . . . . 2.9300000000000002 111.703 177.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.723 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 39.6 mt-10 -66.34 -54.02 29.41 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.575 0.583 . . . . 1.3 112.575 -167.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.512 HD23 ' N ' ' A' ' 59' ' ' LEU . 2.1 pt? -53.75 -36.67 62.58 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.696 -0.684 . . . . 2.1899999999999999 110.775 -176.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 64.9 mtt180 -52.94 -55.65 21.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.54 -0.754 . . . . 3.1400000000000001 111.717 -178.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.617 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 47.9 p90 -90.72 -4.5 56.66 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 121.134 -0.227 . . . . 5.5899999999999999 111.119 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 53.3 ttp180 -54.34 -30.4 51.37 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 122.769 0.428 . . . . 4.9299999999999997 111.646 -177.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.518 ' HD2' ' H ' ' A' ' 63' ' ' ARG . 3.3 mpt_? -66.54 -35.28 79.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.987 0.422 . . . . 5.3499999999999996 110.641 179.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.517 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.35 -27.57 17.46 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.051 -0.522 . . . . 1.7 111.991 -179.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.57 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 51.6 t80 -41.67 -48.54 4.15 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.184 1.179 . . . . 3.52 114.184 -169.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.3 t -63.91 -44.25 93.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.932 0.396 . . . . 2.5899999999999999 110.682 -173.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -72.63 -32.57 66.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.97 -0.559 . . . . 2.7200000000000002 111.067 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.569 HD23 ' NE2' ' A' ' 71' ' ' GLN . 14.5 mt -58.87 -23.53 61.03 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 112.929 0.714 . . . . 2.25 112.929 -174.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.442 HG22 HG13 ' A' ' 74' ' ' ILE . 16.9 p -57.39 -26.27 60.82 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 118.33 0.514 . . . . 1.26 111.217 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -73.35 -24.81 60.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.712 -0.676 . . . . 1.8 109.938 177.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.569 ' NE2' HD23 ' A' ' 68' ' ' LEU . 16.3 mt-30 -87.41 -40.06 14.72 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.456 -0.793 . . . . 1.8899999999999999 110.163 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.55 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.3 mm? -65.56 -32.55 74.21 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.746 -0.465 . . . . 1.98 109.746 173.17 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 72.7 t60 66.33 44.33 2.48 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 107.673 -1.232 . . . . 3.54 107.673 -173.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.574 HG22 ' HE2' ' A' ' 119' ' ' MET . 26.3 mm -51.35 118.33 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 113.759 -1.564 . . . . 1.1499999999999999 111.541 -179.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.772 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.32 -171.82 0.3 Allowed Pre-proline 0 C--N 1.316 -0.877 0 N-CA-C 107.301 -1.37 . . . . 1.1200000000000001 107.301 -170.838 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.772 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 39.2 Cg_exo -29.07 165.36 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 125.07 3.847 . . . . 0.53000000000000003 115.576 165.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.43 -28.53 0.01 OUTLIER Glycine 0 N--CA 1.475 1.279 0 N-CA-C 117.826 1.891 . . . . 0.40999999999999998 117.826 -172.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.45 ' N ' ' O ' ' A' ' 76' ' ' PRO . 35.1 p -69.13 6.92 0.83 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 118.21 1.005 . . . . 1.22 112.476 -179.172 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.81 -11.84 60.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.244 0.545 . . . . 1.0700000000000001 110.192 174.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -76.52 -18.06 58.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.961 -0.563 . . . . 4.3099999999999996 109.673 175.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.42 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 32.8 mt-30 -84.27 -24.22 30.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.895 0.855 . . . . 1.03 109.329 173.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.5 m -71.48 -50.46 31.38 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.542 -1.208 . . . . 0.47999999999999998 109.23 170.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -67.85 -18.69 64.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.252 -0.886 . . . . 1.4399999999999999 110.167 175.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.576 ' HA ' HG13 ' A' ' 87' ' ' VAL . 42.7 tt0 -59.73 -52.17 66.63 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-O 121.605 0.717 . . . . 0.80000000000000004 110.026 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.471 ' H ' ' HG2' ' A' ' 85' ' ' GLN . 57.4 mm-40 -47.47 -35.07 8.12 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.707 -1.588 . . . . 1.99 110.781 177.428 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.84 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -86.36 -49.76 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 CA-C-N 114.519 -1.219 . . . . 1.8999999999999999 111.054 -175.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.576 HG13 ' HA ' ' A' ' 84' ' ' GLU . 9.7 p -62.81 -22.72 31.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.979 0.895 . . . . 1.4299999999999999 109.361 -178.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.603 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 2.6 m-80 -71.08 -52.21 20.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.306 -1.315 . . . . 0.91000000000000003 111.146 174.225 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 1.027 ' HB2' ' HB3' ' B' 1009 ' ' ALA . 0.0 OUTLIER -67.51 -38.22 83.98 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-O 121.754 0.787 . . . . 2.8700000000000001 109.346 -177.039 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.45 ' HG ' ' OE2' ' A' ' 89' ' ' GLU . 18.2 mt -63.01 -24.87 68.12 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 113.867 -1.515 . . . . 1.9199999999999999 111.46 -178.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.667 ' HA ' HG23 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -110.27 -40.61 4.63 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 112.588 0.588 . . . . 2.9700000000000002 112.588 -170.558 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.603 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER -67.8 -29.83 69.11 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.316 0.579 . . . . 5.6699999999999999 110.784 -171.318 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.516 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 1.2 m-20 -98.88 17.22 20.05 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.353 -0.84 . . . . 3.1200000000000001 112.972 -172.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.576 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 126.38 71.75 0.19 Allowed Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 117.18 -2.438 . . . . 2.3100000000000001 115.758 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.667 HG23 ' HA ' ' A' ' 91' ' ' PHE . 57.8 t -71.42 102.73 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-N 118.977 1.388 . . . . 1.6799999999999999 110.698 177.022 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -112.16 -172.53 2.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.848 -1.069 . . . . 2.1200000000000001 110.143 -178.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.691 ' HD1' ' HB3' ' A' ' 145' ' ' ASN . 74.0 t90 -51.46 -49.43 61.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.408 -0.814 . . . . 4.1200000000000001 111.799 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -86.36 -14.42 66.22 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 120.775 -0.726 . . . . 0.80000000000000004 114.04 -174.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.576 ' HG3' ' O ' ' A' ' 94' ' ' GLY . 24.9 mmt180 -64.17 -45.01 90.27 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 117.459 0.63 . . . . 4.9100000000000001 111.398 -176.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.629 ' HA ' ' CD1' ' A' ' 103' ' ' PHE . 66.7 mt -60.0 -30.83 46.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.51 -0.768 . . . . 1.1100000000000001 111.542 -174.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 36.3 t -56.58 -54.63 26.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.653 -0.703 . . . . 2.0299999999999998 110.384 171.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.78 -40.99 63.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.304 -0.862 . . . . 1.0600000000000001 111.875 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.629 ' CD1' ' HA ' ' A' ' 100' ' ' ILE . 68.1 m-85 -50.42 -56.69 10.33 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.311 0.577 . . . . 1.8400000000000001 110.56 177.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.822 ' HA ' ' HE2' ' A' ' 130' ' ' MET . 17.7 m-85 -75.57 -27.4 58.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.546 -0.752 . . . . 4.21 111.178 -174.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.737 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 47.2 m -62.81 -46.36 88.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.863 0.364 . . . . 1.55 110.452 178.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.546 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 56.5 t80 -80.84 -32.36 35.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.232 -0.44 . . . . 3.6400000000000001 110.483 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.766 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.93 -40.42 95.37 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.64 -0.791 . . . . 0.32000000000000001 111.9 176.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 1.055 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.51 -31.0 75.59 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 111.152 -0.779 . . . . 0.23999999999999999 111.152 174.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.57 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -72.42 -32.66 66.52 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 110.02 -0.363 . . . . 1.05 110.02 176.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.421 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.2 OUTLIER -65.66 -36.23 83.06 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.833 0.825 . . . . 1.78 110.123 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.697 ' SG ' HG12 ' A' ' 123' ' ' VAL . 35.8 t -50.55 -48.01 57.51 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 114.468 -1.242 . . . . 0.90000000000000002 109.233 172.06 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.716 HG12 ' HE2' ' A' ' 20' ' ' LYS . 92.3 t -71.04 -32.64 48.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.599 -0.728 . . . . 1.2 110.879 177.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.439 ' HB3' HG23 ' A' ' 74' ' ' ILE . 40.0 mt-10 -57.27 -34.46 68.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.26 0.552 . . . . 2.5099999999999998 110.223 174.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.445 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 16.6 m -77.21 -35.06 55.97 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 115.682 -0.69 . . . . 0.28000000000000003 109.312 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.66 HG22 ' O ' ' A' ' 111' ' ' CYS . 86.9 t -69.04 -35.21 67.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 121.91 0.862 . . . . 1.8300000000000001 109.344 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -53.49 -49.28 67.84 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 113.547 -1.66 . . . . 0.59999999999999998 111.374 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.426 ' CG ' ' HE1' ' A' ' 119' ' ' MET . 34.3 mmtt -88.15 13.09 12.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.856 -0.611 . . . . 2.1600000000000001 110.387 -179.069 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 61.09 52.34 4.06 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.723 0.773 . . . . 1.8799999999999999 110.335 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.574 ' HE2' HG22 ' A' ' 74' ' ' ILE . 28.7 mtm -130.96 44.37 2.97 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 107.781 -1.192 . . . . 1.0800000000000001 107.781 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.633 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 15.1 mp0 -60.02 -6.66 1.43 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.746 -1.116 . . . . 1.1499999999999999 113.465 -172.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.587 HG21 HD23 ' A' ' 122' ' ' LEU . 31.4 m -65.96 -26.63 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 121.943 -0.473 . . . . 1.1899999999999999 111.553 175.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.711 HD11 ' HD2' ' A' ' 125' ' ' ARG . 3.1 mm? -71.85 -27.13 62.68 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 110.373 -0.232 . . . . 1.0600000000000001 110.373 -179.11 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.697 HG12 ' SG ' ' A' ' 111' ' ' CYS . 41.0 t -39.07 -55.56 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 O-C-N 124.33 1.019 . . . . 1.0 112.736 177.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.533 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 5.7 t -77.9 -30.54 50.71 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.642 -0.423 . . . . 1.6599999999999999 110.773 -177.501 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.711 ' HD2' HD11 ' A' ' 122' ' ' LEU . 88.0 mtt180 -66.57 -48.78 68.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.204 -0.453 . . . . 3.2999999999999998 110.997 -176.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.487 HD11 ' HA ' ' A' ' 111' ' ' CYS . 75.3 mt -53.66 -49.9 53.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.731 -0.668 . . . . 1.0600000000000001 110.874 178.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.581 ' HB1' HD22 ' A' ' 13' ' ' LEU . . . -56.53 -36.99 69.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.996 -0.547 . . . . 1.1000000000000001 112.046 -178.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.13 -57.85 10.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.459 0.647 . . . . 1.1200000000000001 110.91 178.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -65.5 -37.32 86.45 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.695 -1.139 . . . . 4.7699999999999996 111.02 -176.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.822 ' HE2' ' HA ' ' A' ' 104' ' ' PHE . 0.4 OUTLIER -61.9 -48.63 79.58 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.034 0.445 . . . . 1.0900000000000001 111.091 179.712 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.59 ' HB1' ' HA ' ' A' ' 6' ' ' ARG . . . -67.75 -37.81 82.63 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 1.05 111.227 -178.059 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 96.9 m -65.57 -45.62 82.59 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.794 -0.363 . . . . 1.1299999999999999 110.982 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.404 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 49.1 t80 -56.47 -43.36 79.53 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.554 -0.536 . . . . 3.3500000000000001 109.554 177.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.977 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.4 OUTLIER -54.9 -61.33 2.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.764 -0.653 . . . . 1.5900000000000001 109.786 170.992 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -43.9 -56.17 4.08 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.3 -0.864 . . . . 0.46000000000000002 112.808 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -76.94 -51.37 11.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.117 0.484 . . . . 0.58999999999999997 111.925 -174.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 0.4 OUTLIER -92.0 -51.56 5.14 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.982 0.734 . . . . 2.3399999999999999 112.982 -170.261 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.977 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -79.51 -42.18 25.77 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 114.492 1.293 . . . . 1.8999999999999999 114.492 -165.718 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.602 ' HA ' HD11 ' A' ' 142' ' ' ILE . 29.2 tt0 -44.09 -48.99 23.21 Favored Pre-proline 0 N--CA 1.472 0.643 0 N-CA-C 112.906 0.706 . . . . 0.75 112.906 -174.137 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.567 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.0 Cg_exo -52.91 -46.77 31.46 Favored 'Trans proline' 0 C--N 1.356 0.957 0 C-N-CA 121.949 1.766 . . . . 0.87 111.952 175.321 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -48.84 78.71 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.801 -0.636 . . . . 1.4299999999999999 110.921 178.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.602 HD11 ' HA ' ' A' ' 139' ' ' GLU . 1.7 mp -49.73 -47.75 21.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.142 0.496 . . . . 1.1299999999999999 110.694 177.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 70.8 mm-40 -64.44 -29.59 70.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.538 -0.756 . . . . 0.57999999999999996 111.991 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.567 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 19.1 mm-40 -62.15 -24.13 66.99 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.784 0.802 . . . . 0.78000000000000003 110.006 176.007 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.691 ' HB3' ' HD1' ' A' ' 97' ' ' TRP . 23.0 m-80 -104.89 10.98 34.15 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.5 -1.227 . . . . 0.93000000000000005 109.715 -174.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 106.56 -12.54 42.89 Favored Glycine 0 N--CA 1.439 -1.164 0 CA-C-N 114.618 -1.174 . . . . 0.56000000000000005 113.116 174.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . 0.507 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 102.29 174.45 27.44 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.366 -0.921 . . . . 0.48999999999999999 112.098 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.4 ' HB3' ' CB ' ' A' ' 46' ' ' VAL . 56.0 m95 -63.97 -42.95 97.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.712 0.291 . . . . 4.5199999999999996 110.936 -178.239 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.466 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 26.9 t70 -53.8 -48.99 69.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.609 . . . . 1.96 110.882 177.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.546 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 67.9 m -58.9 -34.6 71.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.724 -0.671 . . . . 1.24 111.501 179.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -60.45 -45.27 94.29 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.698 -0.482 . . . . 3.7200000000000002 109.698 -179.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.529 HG23 ' HB1' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -72.62 -26.78 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.186 -0.461 . . . . 1.8600000000000001 110.314 178.0 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 18.5 mm-40 -60.98 -29.98 70.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.952 0.406 . . . . 1.6699999999999999 110.244 173.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.9 mt -94.1 -60.25 1.78 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.146 -0.479 . . . . 1.96 110.959 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . 0.666 ' HB2' ' HH2' ' A' ' 97' ' ' TRP . 3.2 t80 -121.05 26.37 9.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.338 0.59 . . . . 4.3899999999999997 110.468 -172.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.472 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -61.45 162.59 24.39 Favored Glycine 0 CA--C 1.499 -0.966 0 CA-C-N 115.716 -0.675 . . . . 1.1000000000000001 112.83 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.543 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 26.4 t-20 -55.6 111.58 0.93 Allowed 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 114.12 -1.04 . . . . 1.29 110.754 178.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.42 ' ND2' ' HG3' ' A' ' 162' ' ' GLU . 10.5 t30 -100.43 -3.61 30.62 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 121.32 0.581 . . . . 3.4399999999999999 109.918 -176.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.82 -47.2 86.68 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.004 -0.544 . . . . 2.6699999999999999 110.271 175.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.98 -36.44 83.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.809 -0.632 . . . . 2.8700000000000001 110.369 174.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 158' ' ' ASN . . . -59.12 -48.33 81.98 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.558 -0.746 . . . . 3.2000000000000002 110.768 178.152 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.42 ' HG3' ' ND2' ' A' ' 158' ' ' ASN . 45.0 mt-10 -68.61 -31.72 71.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.959 -0.564 . . . . 3.7200000000000002 111.234 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 70.1 m -61.43 -47.61 84.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.936 0.398 . . . . 4.2000000000000002 110.849 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -90.89 0.04 57.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.495 -0.32 . . . . 6.3700000000000001 111.798 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -63.27 -43.14 98.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.641 0.258 . . . . 5.0099999999999998 111.61 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -57.79 -59.45 10.81 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.204 -0.522 . . . . 5.0999999999999996 112.832 -175.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.496 ' HB2' ' CE1' ' A' ' 175' ' ' HIS . 12.0 pt20 -71.89 -17.21 62.13 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 111.979 0.362 . . . . 5.9400000000000004 111.979 -177.111 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -69.57 -18.12 63.61 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.343 0.592 . . . . 5.8799999999999999 110.049 177.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.643 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 1.1 tmt_? -91.19 -17.8 25.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.347 0.594 . . . . 7.7999999999999998 109.442 -177.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.408 HD11 ' HA ' ' A' ' 170' ' ' LEU . 4.0 mm? -87.17 28.97 0.87 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.865 -0.607 . . . . 7.29 111.045 -177.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -85.8 -0.28 54.87 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.854 -0.612 . . . . 6.9699999999999998 110.699 -177.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -73.84 -6.67 48.49 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.235 0.541 . . . . 9.8100000000000005 110.388 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -158.27 173.18 17.08 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.367 -0.975 . . . . 11.99 108.367 176.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -80.68 91.8 5.91 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 119.975 -0.69 . . . . 11.949999999999999 110.094 179.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . 0.496 ' CE1' ' HB2' ' A' ' 167' ' ' GLN . 6.4 p80 -77.87 136.91 38.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.739 -0.664 . . . . 14.949999999999999 110.156 -178.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -96.09 -52.57 3.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.562 -0.29 . . . . 15.880000000000001 110.994 -177.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 85.7 t60 61.69 96.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 O-C-N 123.858 0.724 . . . . 16.02 110.667 -176.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 89.7 mt -69.66 130.1 41.45 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.772 -0.649 . . . . 18.210000000000001 110.542 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -113.43 104.65 12.5 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.802 -0.635 . . . . 19.219999999999999 109.413 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 47.3 t-80 -91.84 102.69 15.29 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.242 0.544 . . . . 22.800000000000001 110.734 -176.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -132.23 -26.2 1.91 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.664 -0.698 . . . . 22.510000000000002 109.761 176.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 38.4 m80 -79.98 138.24 37.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.062 -0.517 . . . . 25.300000000000001 110.317 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -103.98 -178.78 3.76 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.021 -0.536 . . . . 25.77 110.462 -177.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 37.8 p-80 -143.59 129.42 19.39 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.364 -0.38 . . . . 27.370000000000001 110.077 175.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 42.6 t60 . . . . . 0 C--O 1.247 0.926 0 CA-C-O 118.322 -0.847 . . . . 29.52 109.557 -179.743 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.239 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -83.03 57.2 5.08 Favored Glycine 0 N--CA 1.451 -0.341 0 O-C-N 121.561 -0.712 . . . . 2.9900000000000002 112.078 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.551 ' O ' HG23 ' B' 1004 ' ' VAL . 22.3 m -119.89 -140.31 0.34 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 110.032 -0.359 . . . . 1.9399999999999999 110.032 -178.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.574 ' C ' ' H ' ' B' 1006 ' ' ARG . 1.7 m 52.13 -178.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 C-N-CA 125.11 1.364 . . . . 1.9399999999999999 111.761 -174.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 0.894 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . 46.25 5.35 0.01 OUTLIER Glycine 0 CA--C 1.541 1.679 0 C-N-CA 120.93 -0.652 . . . . 1.26 114.188 -160.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B 1006 ' ' ARG . . . . . 0.574 ' H ' ' C ' ' B' 1004 ' ' VAL . 24.2 mmt180 -139.51 -41.58 0.45 Allowed 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 123.446 0.698 . . . . 3.4500000000000002 109.754 177.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B 1007 ' ' ALA . . . . . 0.521 ' O ' ' HD1' ' B' 1011 ' ' PHE . . . -59.9 -61.06 2.89 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 116.19 -0.459 . . . . 1.54 111.307 -177.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.798 ' H ' HD23 ' B' 1008 ' ' LEU . 1.0 OUTLIER -63.45 -39.8 95.43 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.49 -0.93 . . . . 1.8999999999999999 108.49 -179.19 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 1.027 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . . . -48.6 -49.97 34.6 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.521 -1.218 . . . . 1.45 110.58 172.213 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.636 ' HB2' ' H13' ' B' 1100 ' ' 33B . . . -78.18 -43.52 28.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.704 -1.135 . . . . 1.51 112.021 -175.136 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.614 ' HE1' ' H8 ' ' B' 1100 ' ' 33B . 46.3 m-85 -67.14 -26.73 66.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.223 0.535 . . . . 2.0699999999999998 110.42 178.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B 1012 ' ' GLY . . . . . 0.433 ' HA2' ' HE1' ' A' ' 57' ' ' PHE . . . -79.93 -6.77 88.98 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.45 -0.796 . . . . 0.80000000000000004 112.606 178.24 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 26.9 t70 -81.59 -2.95 51.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.483 0.658 . . . . 1.8999999999999999 109.941 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 20.2 m -91.08 19.74 5.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.883 -0.599 . . . . 1.4399999999999999 111.045 -178.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.489 ' HB ' ' H ' ' B' 1016 ' ' ASN . 13.9 pt -82.54 -151.65 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 3.4300000000000002 110.601 176.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B 1016 ' ' ASN . . . . . 0.489 ' H ' ' HB ' ' B' 1015 ' ' ILE . 25.4 p-10 -62.89 -29.84 71.07 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.946 0.403 . . . . 4.79 110.518 175.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B 1017 ' ' ARG . . . . . 0.448 ' H ' HG13 ' B' 1015 ' ' ILE . 42.6 mtp180 -133.81 94.13 3.23 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.842 -0.617 . . . . 8.9800000000000004 110.402 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.626 0 CA-C-N 116.424 -0.353 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.692 ' H15' ' O19' ' B' 1100 ' ' 33B . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.8 mtm . . . . . 0 N--CA 1.484 1.233 0 CA-C-O 120.656 0.265 . . . . 6.4500000000000002 110.853 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.1 m -85.81 108.21 18.0 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.811 -0.44 . . . . 2.2599999999999998 109.811 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.631 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 76.4 mm-40 -71.22 2.2 5.0 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.418 0.895 . . . . 2.7599999999999998 113.418 -171.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.0 p -68.68 -18.31 64.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.109 0.48 . . . . 1.54 110.626 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.7 ' HB2' HD12 ' A' ' 134' ' ' LEU . 13.2 p30 -68.88 -20.76 64.27 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.029 -0.532 . . . . 1.78 111.06 176.304 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.631 ' HB2' ' O ' ' A' ' 3' ' ' GLN . 0.1 OUTLIER -51.96 -51.77 54.88 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.801 -0.636 . . . . 1.8999999999999999 110.31 175.95 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.625 ' CD ' ' HG ' ' A' ' 43' ' ' SER . 40.2 mt-10 -59.39 -48.2 82.56 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.867 -1.06 . . . . 0.68000000000000005 111.453 -176.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.648 HD22 ' HA ' ' A' ' 5' ' ' ASN . 1.4 mp -49.61 -34.55 18.28 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.439 -0.8 . . . . 1.8 111.087 176.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.557 ' CG2' ' HE1' ' A' ' 104' ' ' PHE . 72.6 t -79.39 -63.1 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.498 0.666 . . . . 1.0700000000000001 109.909 174.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 6' ' ' ARG . 93.6 t -50.66 -56.6 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.471 -1.241 . . . . 1.1299999999999999 112.766 -174.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.08 -33.08 68.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.709 0.29 . . . . 0.58999999999999997 110.469 -177.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.482 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 4.0 t80 -74.97 -46.2 37.03 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.287 -0.415 . . . . 2.02 110.735 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.922 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.9 mp -62.72 -40.79 98.3 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 120.103 -0.639 . . . . 1.0600000000000001 110.202 178.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.8 t -61.17 -40.7 94.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.172 0.51 . . . . 1.6000000000000001 110.065 176.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.412 ' HD2' ' HE3' ' A' ' 16' ' ' LYS . 81.3 t80 -63.15 -22.1 66.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.529 -0.759 . . . . 1.49 110.889 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.698 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.5 mmpt? -86.35 -43.75 12.62 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.516 0.674 . . . . 1.8400000000000001 110.203 -179.057 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.652 HD23 ' SG ' ' A' ' 111' ' ' CYS . 14.5 mt -66.69 -30.86 71.2 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 115.018 -0.992 . . . . 1.98 110.69 178.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.0 t -56.31 -43.51 79.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.541 -0.754 . . . . 1.3799999999999999 111.564 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -80.22 0.97 30.22 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.073 0.463 . . . . 1.51 112.103 -177.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.632 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 19.9 mmmt -108.28 -26.5 10.51 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 122.113 0.959 . . . . 2.6499999999999999 108.788 177.42 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 22.28 10.37 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 113.642 -1.617 . . . . 0.54000000000000004 111.47 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.737 ' HB3' ' HE2' ' A' ' 27' ' ' PHE . 89.9 m-85 -113.13 156.39 23.27 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.855 0.36 . . . . 1.1200000000000001 110.879 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.7 t -93.13 147.75 22.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.811 -0.631 . . . . 0.75 110.688 -179.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -73.33 -53.01 11.84 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.794 -0.639 . . . . 4.29 110.022 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -68.4 -28.89 67.49 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.186 0.439 . . . . 1.8600000000000001 112.186 -173.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -61.22 -29.63 69.94 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.672 -0.411 . . . . 1.52 111.363 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.737 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 13.5 m-85 -109.96 -15.34 14.09 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.3 -0.409 . . . . 1.53 111.338 -175.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.572 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 34.6 m -101.36 148.34 25.27 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 122.254 1.026 . . . . 2.04 112.632 -176.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.29 -2.84 11.07 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 113.113 -1.858 . . . . 2.3100000000000001 109.149 -177.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.604 HG22 ' H ' ' A' ' 31' ' ' GLU . 5.2 m -64.66 -75.76 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 114.636 -1.166 . . . . 1.4099999999999999 113.141 -169.132 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.604 ' H ' HG22 ' A' ' 30' ' ' VAL . 10.2 mm-40 -85.24 -2.28 57.87 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 122.075 0.94 . . . . 2.7400000000000002 108.861 -179.191 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -64.67 -41.29 96.19 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.188 -1.369 . . . . 1.45 110.425 174.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.5 m-80 -106.0 -9.05 17.24 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.924 -0.58 . . . . 1.8700000000000001 112.198 -173.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.594 ' HG2' ' O ' ' A' ' 30' ' ' VAL . 19.3 ptp180 -128.71 155.93 44.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.017 0.437 . . . . 3.8199999999999998 111.245 -177.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.9 p -127.9 102.95 7.0 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.777 -0.647 . . . . 2.6699999999999999 109.611 174.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.469 ' OE2' ' HD3' ' A' ' 34' ' ' ARG . 56.6 mt-10 -138.57 -69.24 0.44 Allowed 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.64 -0.709 . . . . 3.3399999999999999 111.05 -171.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.471 ' HB3' ' HG3' ' A' ' 7' ' ' GLU . . . -73.83 136.45 76.98 Favored Pre-proline 0 C--N 1.322 -0.615 0 C-N-CA 120.845 -0.342 . . . . 2.4399999999999999 110.9 177.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.831 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 26.2 Cg_exo -64.52 -175.03 0.31 Allowed 'Trans proline' 0 CA--C 1.53 0.299 0 C-N-CA 123.404 2.736 . . . . 1.8700000000000001 111.794 173.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -83.94 -8.53 59.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.524 0.678 . . . . 4.6399999999999997 109.836 176.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.424 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 159.44 71.55 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.874 0 CA-C-N 115.028 -0.987 . . . . 2.3999999999999999 111.318 -176.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.831 ' HB ' ' HG2' ' A' ' 38' ' ' PRO . 1.2 t -71.62 -75.27 0.13 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.538 -0.465 . . . . 1.45 110.408 -175.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.801 ' H ' HG21 ' A' ' 41' ' ' THR . 17.0 pt-20 -94.7 -23.51 17.54 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 122.999 1.38 . . . . 2.02 108.291 165.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.826 ' HB2' ' HE3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -63.04 -30.0 71.25 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 111.955 -2.384 . . . . 1.25 114.562 -169.725 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -46.19 -50.31 15.88 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 118.202 0.455 . . . . 1.9099999999999999 111.614 -173.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.567 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -74.93 -37.75 61.96 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.982 0.42 . . . . 1.1799999999999999 110.368 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.573 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 72.2 t -54.93 -65.21 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.37 -0.832 . . . . 2.0099999999999998 111.306 177.132 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.826 ' HE3' ' HB2' ' A' ' 43' ' ' SER . 19.3 ptpt -60.85 -34.51 74.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.865 -0.607 . . . . 1.3799999999999999 110.176 -176.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.605 HE21 ' ND2' ' A' ' 157' ' ' ASN . 6.8 mm100 -62.34 -36.36 81.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.64 -0.709 . . . . 0.98999999999999999 111.446 174.264 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.708 ' HB3' ' HA2' ' A' ' 156' ' ' GLY . . . -76.85 -35.25 57.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.497 0.665 . . . . 1.1399999999999999 110.066 175.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.564 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -54.85 -39.29 68.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.742 -1.117 . . . . 1.95 112.118 -179.771 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.506 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 13.0 ptp180 -79.59 -33.53 41.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.588 0.709 . . . . 2.5099999999999998 109.426 -174.381 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.672 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.0 mm-40 -67.95 -43.67 78.52 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.582 -1.19 . . . . 1.1000000000000001 110.218 178.082 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.57 -41.49 72.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.495 -0.775 . . . . 1.04 110.723 177.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.69 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.41 -44.62 97.36 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.825 -0.625 . . . . 0.69999999999999996 112.52 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.544 ' O ' HD23 ' A' ' 59' ' ' LEU . 28.8 t70 -54.33 -32.01 55.64 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.074 0.464 . . . . 1.04 111.294 -178.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -80.22 -25.6 39.54 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.379 -0.828 . . . . 2.29 112.488 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.616 ' CZ ' HD13 ' B' 1008 ' ' LEU . 91.7 t80 -82.54 -43.05 17.59 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.566 0.58 . . . . 2.9300000000000002 112.566 -179.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.69 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 30.4 mt-10 -58.33 -48.03 81.85 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.494 0.924 . . . . 1.3 113.494 -168.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.56 ' H ' ' CD2' ' A' ' 59' ' ' LEU . 1.0 OUTLIER -78.74 -7.81 58.13 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 123.717 0.807 . . . . 2.1899999999999999 112.409 -172.119 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 67.8 mtt-85 -45.01 -27.39 0.54 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 116.221 1.934 . . . . 3.1400000000000001 116.221 -161.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -90.38 -85.94 0.21 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 117.16 -1.816 . . . . 5.5899999999999999 109.894 174.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 56.6 mtm180 -109.18 -82.06 0.57 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 119.534 1.061 . . . . 4.9299999999999997 111.636 158.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.661 ' HB2' ' OD1' ' A' ' 67' ' ' ASP . 0.0 OUTLIER -103.07 11.65 36.93 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 113.844 -1.525 . . . . 5.3499999999999996 110.966 171.182 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.727 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -27.89 -54.99 0.1 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.378 1.622 . . . . 1.7 115.378 -150.371 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.437 ' CG ' ' HB3' ' A' ' 58' ' ' GLU . 19.6 p90 -47.82 -28.57 2.64 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 113.088 0.773 . . . . 3.52 113.088 -176.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.7 m -90.69 -36.66 14.22 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.202 0.445 . . . . 2.5899999999999999 112.202 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.661 ' OD1' ' HB2' ' A' ' 63' ' ' ARG . 4.5 m-20 -83.01 -23.21 33.37 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.799 0.296 . . . . 2.7200000000000002 111.799 -174.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 32.2 mt -61.47 -15.55 38.61 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.717 1.006 . . . . 2.25 113.717 -171.675 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.709 HG22 HG13 ' A' ' 74' ' ' ILE . 34.4 p -47.81 -29.27 3.06 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 123.314 0.384 . . . . 1.26 111.482 -177.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.8 t -53.28 -59.38 4.64 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.752 -0.658 . . . . 1.8 111.143 175.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.626 ' NE2' ' HA ' ' A' ' 68' ' ' LEU . 2.6 mp0 -54.51 -48.09 72.31 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.682 0.793 . . . . 1.8899999999999999 111.814 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.728 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.1 mp -81.25 -28.27 34.84 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.104 -0.953 . . . . 1.98 111.922 -168.081 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.5 t-80 62.8 64.38 0.89 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 122.155 0.978 . . . . 3.54 108.711 -177.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.709 HG13 HG22 ' A' ' 69' ' ' THR . 15.5 mm -65.03 118.54 7.54 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 113.963 -1.472 . . . . 1.1499999999999999 111.627 -174.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.736 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.26 -172.18 0.3 Allowed Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 107.47 -1.307 . . . . 1.1200000000000001 107.47 -171.247 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.736 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.3 Cg_exo -30.33 167.27 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 125.035 3.823 . . . . 0.53000000000000003 115.112 164.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.41 -25.68 0.0 OUTLIER Glycine 0 N--CA 1.475 1.239 0 N-CA-C 117.606 1.803 . . . . 0.40999999999999998 117.606 -174.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.473 ' N ' ' O ' ' A' ' 76' ' ' PRO . 34.6 p -72.05 6.76 1.95 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 118.119 0.959 . . . . 1.22 111.514 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.46 -16.71 61.81 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 109.304 -0.628 . . . . 1.0700000000000001 109.304 169.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.526 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 66.2 t80 -76.06 -15.12 60.17 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.574 -0.739 . . . . 4.3099999999999996 109.186 174.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.481 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 78.1 mt-30 -82.85 -28.79 29.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.766 0.793 . . . . 1.03 109.487 172.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.728 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.5 m -72.05 -53.14 13.8 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.58 -1.191 . . . . 0.47999999999999998 109.687 173.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.489 ' HE1' ' HB3' ' A' ' 106' ' ' PHE . 78.8 t80 -65.13 -18.94 65.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.559 -0.746 . . . . 1.4399999999999999 110.345 175.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.646 ' HA ' HG13 ' A' ' 87' ' ' VAL . 42.6 tt0 -60.59 -46.91 88.48 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 115.724 -0.671 . . . . 0.80000000000000004 110.426 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -49.1 -34.6 14.25 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.749 -1.114 . . . . 1.99 110.796 177.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.792 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.4 t -82.68 -54.72 8.84 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.025 -0.988 . . . . 1.8999999999999999 110.867 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.646 HG13 ' HA ' ' A' ' 84' ' ' GLU . 9.8 p -60.46 -25.31 33.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.537 0.684 . . . . 1.4299999999999999 109.648 -177.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.0 OUTLIER -62.08 -56.5 18.27 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.789 -1.096 . . . . 0.91000000000000003 110.742 171.607 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.896 ' HB2' ' HB1' ' B' 1009 ' ' ALA . 1.0 OUTLIER -62.05 -36.36 81.4 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 108.428 -0.953 . . . . 2.8700000000000001 108.428 -175.738 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.765 HD23 ' HE ' ' A' ' 99' ' ' ARG . 27.3 mt -70.9 -24.28 62.44 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 113.672 -1.603 . . . . 1.9199999999999999 112.345 -170.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.728 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 1.7 p90 -106.81 -23.56 12.35 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.052 0.453 . . . . 2.9700000000000002 111.516 -176.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.531 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 5.8 ptm180 -88.18 -41.56 12.9 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.889 0.376 . . . . 5.6699999999999999 111.71 -172.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -100.83 18.11 20.34 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.824 0.676 . . . . 3.1200000000000001 112.824 -165.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.503 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 129.03 69.38 0.12 Allowed Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 117.574 -2.25 . . . . 2.3100000000000001 114.846 178.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.728 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 61.1 t -70.7 103.94 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 118.421 1.111 . . . . 1.6799999999999999 110.416 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.649 HD21 ' N ' ' A' ' 96' ' ' ASN . 0.7 OUTLIER -110.93 -175.06 2.62 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.973 -1.012 . . . . 2.1200000000000001 108.427 176.562 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.529 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 21.8 m-90 -54.72 -47.33 73.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.008 0.432 . . . . 4.1200000000000001 110.27 178.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.664 ' HA3' ' HB ' ' B' 1015 ' ' ILE . . . -69.13 -30.47 71.9 Favored Glycine 0 CA--C 1.519 0.317 0 CA-C-N 115.738 -0.664 . . . . 0.80000000000000004 113.772 -176.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.765 ' HE ' HD23 ' A' ' 90' ' ' LEU . 9.9 mmm-85 -62.68 -35.61 80.23 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.4 0.619 . . . . 4.9100000000000001 110.798 -178.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.497 ' O ' ' HB3' ' A' ' 103' ' ' PHE . 72.5 mt -75.01 -41.25 45.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 CA-C-N 115.53 -0.759 . . . . 1.1100000000000001 110.812 -177.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -59.53 -35.93 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 109.671 -0.492 . . . . 2.0299999999999998 109.671 174.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.16 87.27 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.786 -0.643 . . . . 1.0600000000000001 110.632 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.55 ' HZ ' ' HA ' ' A' ' 130' ' ' MET . 67.4 t80 -51.9 -42.87 63.06 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.13 -0.941 . . . . 1.8400000000000001 110.12 173.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.883 ' HA ' ' HE1' ' A' ' 130' ' ' MET . 89.0 m-85 -75.41 -39.7 58.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.076 -0.511 . . . . 4.21 111.367 178.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.482 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 19.3 m -56.16 -50.13 72.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.063 0.459 . . . . 1.55 110.365 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.512 ' HZ ' HD12 ' A' ' 72' ' ' LEU . 1.2 t80 -79.07 -35.42 42.47 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.95 -0.568 . . . . 3.6400000000000001 110.569 -178.226 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.655 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.06 -43.46 95.7 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.75 -0.738 . . . . 0.32000000000000001 111.999 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.922 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.64 -33.02 79.7 Favored Glycine 0 N--CA 1.443 -0.89 0 N-CA-C 110.875 -0.89 . . . . 0.23999999999999999 110.875 175.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.77 -34.25 73.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.47 -0.365 . . . . 1.05 110.606 176.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.526 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.47 -39.57 94.81 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 108.257 -1.016 . . . . 1.78 108.257 -178.806 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.671 ' SG ' HG13 ' A' ' 123' ' ' VAL . 43.9 t -52.78 -52.6 56.04 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 113.899 -1.5 . . . . 0.90000000000000002 109.913 173.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.579 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 92.6 t -68.07 -38.43 79.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.97 -0.559 . . . . 1.2 111.686 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.52 ' HB3' HG23 ' A' ' 74' ' ' ILE . 35.7 mt-10 -58.11 -28.17 64.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.158 0.504 . . . . 2.5099999999999998 110.027 176.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.44 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 50.8 m -79.01 -41.28 29.29 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.859 -0.61 . . . . 0.28000000000000003 109.503 176.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.639 HG22 ' O ' ' A' ' 111' ' ' CYS . 88.0 t -64.04 -33.92 65.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 122.066 0.936 . . . . 1.8300000000000001 109.455 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . 0.442 ' OD1' ' HD3' ' A' ' 117' ' ' LYS . 15.2 t70 -51.54 -50.39 60.14 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 113.401 -1.727 . . . . 0.59999999999999998 111.278 178.186 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.447 ' CG ' ' HE1' ' A' ' 119' ' ' MET . 12.1 mmtp -88.33 13.3 11.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.061 -0.518 . . . . 2.1600000000000001 110.231 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 63.2 42.84 6.76 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-O 121.657 0.742 . . . . 1.8799999999999999 110.749 -177.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.45 ' HE3' ' HB2' ' A' ' 119' ' ' MET . 29.7 mtm -116.16 46.29 1.6 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.069 -1.086 . . . . 1.0800000000000001 108.069 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.448 ' HA ' HG23 ' A' ' 123' ' ' VAL . 3.7 mt-30 -61.61 -7.45 3.35 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.468 -1.242 . . . . 1.1499999999999999 112.847 -175.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.602 HG21 HD21 ' A' ' 122' ' ' LEU . 27.8 m -65.82 -27.31 40.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 122.244 -0.285 . . . . 1.1899999999999999 111.067 173.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.685 HD11 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -70.8 -29.45 65.64 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 116.569 -0.287 . . . . 1.0600000000000001 110.321 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.671 HG13 ' SG ' ' A' ' 111' ' ' CYS . 76.3 t -43.05 -55.5 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 O-C-N 124.001 0.813 . . . . 1.0 111.909 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.572 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 2.9 t -70.32 -35.0 73.36 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.779 0.323 . . . . 1.6599999999999999 110.914 -178.103 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.685 ' HD2' HD11 ' A' ' 122' ' ' LEU . 94.7 mtt180 -63.47 -56.02 19.46 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 121.13 0.491 . . . . 3.2999999999999998 110.158 -178.243 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.526 HD13 ' HB3' ' A' ' 110' ' ' LEU . 68.8 mt -51.82 -53.72 16.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.139 -0.937 . . . . 1.0600000000000001 110.964 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.547 ' HB1' HD21 ' A' ' 13' ' ' LEU . . . -54.84 -34.45 62.87 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 111.711 0.263 . . . . 1.1000000000000001 111.711 -178.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.13 -58.05 8.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.48 0.657 . . . . 1.1200000000000001 110.892 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -68.76 -26.1 65.05 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.026 -0.988 . . . . 4.7699999999999996 111.224 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.883 ' HE1' ' HA ' ' A' ' 104' ' ' PHE . 21.5 mmm -62.87 -60.57 3.29 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.168 -0.469 . . . . 1.0900000000000001 110.683 176.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.556 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -62.37 -35.11 78.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.173 -0.467 . . . . 1.05 110.972 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 89.6 m -63.71 -47.47 80.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.336 -0.393 . . . . 1.1299999999999999 111.261 176.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -60.35 -37.35 80.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.96 -0.385 . . . . 3.3500000000000001 109.96 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.806 HD13 ' HZ ' ' A' ' 104' ' ' PHE . 5.9 tt -64.1 -50.2 69.21 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.752 -0.832 . . . . 1.5900000000000001 108.752 173.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -47.95 -57.37 5.82 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.878 -0.601 . . . . 0.46000000000000002 112.028 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -80.85 -48.85 11.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.398 0.518 . . . . 0.58999999999999997 112.398 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -90.77 -47.81 7.41 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.127 0.788 . . . . 2.3399999999999999 113.127 -169.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.439 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 58.2 mt -91.04 -32.89 15.73 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.011 0.745 . . . . 1.8999999999999999 113.011 -165.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.62 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 29.6 tt0 -49.67 -50.23 68.07 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 111.915 0.339 . . . . 0.75 111.915 -174.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.593 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 13.3 Cg_endo -57.83 -49.7 12.36 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.902 1.735 . . . . 0.87 111.913 175.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . 0.419 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -56.02 -47.41 77.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.721 -0.672 . . . . 1.4299999999999999 110.471 179.282 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.613 HD13 ' HA ' ' A' ' 139' ' ' GLU . 15.0 mt -50.15 -50.86 19.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.609 -0.723 . . . . 1.1299999999999999 111.27 175.2 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.62 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 80.8 mm-40 -58.84 -34.09 71.18 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.572 -0.74 . . . . 0.57999999999999996 111.252 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.593 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 6.1 mm-40 -66.57 -21.71 66.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.381 0.61 . . . . 0.78000000000000003 110.773 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.628 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -102.42 -4.95 24.68 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.504 -0.771 . . . . 0.93000000000000005 109.787 -174.743 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 123.13 -31.92 4.54 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.479 -0.782 . . . . 0.56000000000000005 112.851 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . 0.484 ' HA2' HG21 ' A' ' 142' ' ' ILE . . . 123.45 -175.48 16.71 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.731 -0.747 . . . . 0.48999999999999999 112.046 -178.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.542 ' NE1' HD12 ' A' ' 142' ' ' ILE . 11.2 m-90 -78.68 -39.69 36.01 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.839 0.352 . . . . 4.5199999999999996 110.38 -178.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -61.98 -42.21 98.88 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.109 -0.496 . . . . 1.96 110.07 179.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.594 ' O ' HD12 ' A' ' 154' ' ' LEU . 85.0 m -57.4 -35.5 70.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.768 -0.651 . . . . 1.24 110.869 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.529 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 78.7 t80 -60.66 -39.84 89.85 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 120.43 -0.508 . . . . 3.7200000000000002 110.102 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.571 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -78.18 -26.19 14.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.158 0.504 . . . . 1.8600000000000001 110.331 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -59.33 -42.32 91.19 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.399 0.619 . . . . 1.6699999999999999 109.695 171.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.594 HD12 ' O ' ' A' ' 150' ' ' THR . 8.1 mp -80.37 -60.04 2.47 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.093 -0.958 . . . . 1.96 112.873 177.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -119.86 27.04 8.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.272 0.558 . . . . 4.3899999999999997 110.203 -168.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.708 ' HA2' ' HB3' ' A' ' 49' ' ' ALA . . . -57.17 161.69 8.22 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-O 122.022 0.79 . . . . 1.1000000000000001 114.665 -178.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.672 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 28.1 t-20 -50.68 140.0 15.33 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 113.202 -1.499 . . . . 1.29 111.601 178.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.657 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 2.5 m120 -66.3 -29.18 69.33 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.427 0.528 . . . . 3.4399999999999999 112.427 -174.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . 0.409 ' HB1' ' OD1' ' A' ' 157' ' ' ASN . . . -60.59 -28.34 68.41 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.112 0.482 . . . . 2.6699999999999999 110.056 175.509 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -87.18 -34.53 18.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.972 -0.558 . . . . 2.8700000000000001 110.052 174.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 0.442 ' HB1' ' HA ' ' A' ' 158' ' ' ASN . . . -59.99 -51.6 68.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.917 -0.583 . . . . 3.2000000000000002 111.072 177.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.657 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 5.8 pt-20 -62.23 -27.75 69.21 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.664 0.268 . . . . 3.7200000000000002 111.399 175.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 12.5 t -70.5 -29.59 66.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.407 0.622 . . . . 4.2000000000000002 109.548 178.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 -79.07 -40.32 31.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.671 0.748 . . . . 6.3700000000000001 109.791 172.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -58.44 -42.25 86.93 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.622 -1.172 . . . . 5.0099999999999998 110.652 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -66.02 -40.69 95.32 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.833 -0.621 . . . . 5.0999999999999996 112.873 -178.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -74.91 -30.19 61.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 117.163 0.482 . . . . 5.9400000000000004 110.375 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . 0.78 ' HA ' ' HB2' ' A' ' 171' ' ' GLU . 47.8 mt-10 -82.72 10.49 7.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 5.8799999999999999 110.682 176.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.495 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 0.2 OUTLIER -79.91 -26.16 40.29 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.526 -0.916 . . . . 7.7999999999999998 108.526 174.778 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -90.63 -33.63 15.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.39 -0.823 . . . . 7.29 109.377 171.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . 0.78 ' HB2' ' HA ' ' A' ' 168' ' ' GLU . 8.5 mm-40 -73.93 -175.73 2.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.055 -0.975 . . . . 6.9699999999999998 110.401 176.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -127.95 129.11 46.27 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.237 -0.438 . . . . 9.8100000000000005 109.838 173.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -65.8 114.88 5.38 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.458 0.647 . . . . 11.99 111.047 -175.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 45.4 p-80 -128.27 138.64 52.51 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.13 -0.941 . . . . 11.949999999999999 109.879 -177.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -79.58 10.92 3.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.322 -0.399 . . . . 14.949999999999999 111.688 -172.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 65.75 82.95 0.17 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.126 -0.488 . . . . 15.880000000000001 111.07 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 63.26 53.21 2.26 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.622 -0.717 . . . . 16.02 111.121 175.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.448 ' HB3' ' H ' ' A' ' 179' ' ' GLU . 7.7 mp 63.64 -158.73 0.31 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.777 -0.647 . . . . 18.210000000000001 111.401 177.496 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . 0.448 ' H ' ' HB3' ' A' ' 178' ' ' LEU . 11.6 pt-20 -132.46 -28.42 1.66 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.191 -0.459 . . . . 19.219999999999999 110.633 177.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 -141.73 104.42 4.53 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.985 -0.552 . . . . 22.800000000000001 109.944 178.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 70.9 m80 -70.25 170.85 10.84 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.897 -0.592 . . . . 22.510000000000002 110.594 178.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -130.09 110.1 11.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.445 -0.343 . . . . 25.300000000000001 110.319 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -125.47 144.49 50.51 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.432 -0.349 . . . . 25.77 110.431 176.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -66.2 -42.12 89.25 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.985 -0.552 . . . . 27.370000000000001 111.431 -174.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 30.1 p-80 . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.297 -0.858 . . . . 29.52 110.353 -178.889 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.239 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -69.02 -31.11 72.13 Favored Glycine 0 N--CA 1.45 -0.425 0 N-CA-C 111.623 -0.591 . . . . 2.9900000000000002 111.623 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.685 ' HB3' ' O62' ' B' 1100 ' ' 33B . 22.4 m -110.65 -143.34 0.39 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.329 -0.619 . . . . 1.9399999999999999 109.329 175.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.92 HG23 ' H ' ' B' 1005 ' ' GLY . 32.2 m 43.39 -84.58 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 124.547 1.139 . . . . 1.9399999999999999 113.546 175.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 0.92 ' H ' HG23 ' B' 1004 ' ' VAL . . . -32.35 -38.01 0.05 OUTLIER Glycine 0 CA--C 1.53 1.013 0 CA-C-N 118.895 0.771 . . . . 1.26 113.014 160.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B 1006 ' ' ARG . . . . . 0.497 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 3.7 mpt_? -90.59 -41.74 11.18 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.776 0.322 . . . . 3.4500000000000002 111.241 175.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B 1007 ' ' ALA . . . . . 0.513 ' HB1' ' C6 ' ' B' 1100 ' ' 33B . . . -70.32 -66.13 0.64 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.466 0.543 . . . . 1.54 112.466 -171.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.616 HD13 ' CZ ' ' A' ' 57' ' ' PHE . 3.3 mm? -57.5 -40.04 77.83 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.312 0.577 . . . . 1.8999999999999999 110.18 -173.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 0.896 ' HB1' ' HB2' ' A' ' 89' ' ' GLU . . . -53.92 -40.19 66.48 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.642 -1.163 . . . . 1.45 110.726 176.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.668 ' HB3' ' C13' ' B' 1100 ' ' 33B . . . -80.25 -41.22 25.48 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.827 -1.078 . . . . 1.51 111.143 -177.493 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.574 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 49.2 m-85 -70.52 -33.63 71.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.702 -0.681 . . . . 2.0699999999999998 111.581 -178.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -70.84 -24.42 77.05 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.188 -0.53 . . . . 0.80000000000000004 113.367 -175.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 38.5 t70 -74.19 -4.24 34.72 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.206 0.527 . . . . 1.8999999999999999 111.061 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 22.4 m -86.33 -13.79 45.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.011 0.434 . . . . 1.4399999999999999 110.202 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.664 ' HB ' ' HA3' ' A' ' 98' ' ' GLY . 27.5 mt -80.44 69.33 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.551 0.691 . . . . 3.4300000000000002 109.764 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 10.8 p30 -131.29 179.25 6.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.384 -0.825 . . . . 4.79 109.982 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -95.33 94.63 7.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.875 0.369 . . . . 8.9800000000000004 110.351 -179.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.607 0 CA-C-N 116.415 -0.357 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.685 ' O62' ' HB3' ' B' 1003 ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.7 ptp . . . . . 0 N--CA 1.483 1.21 0 CA-C-O 120.897 0.38 . . . . 6.4500000000000002 110.707 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.503 ' HB3' ' OD1' ' A' ' 135' ' ' ASN . 49.4 m -81.54 12.21 3.96 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.141 -0.482 . . . . 2.2599999999999998 111.862 -177.185 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.637 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 26.8 mp0 -100.36 -22.53 15.04 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.61 -0.268 . . . . 2.7599999999999998 110.985 177.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.57 ' HB3' ' HB3' ' A' ' 43' ' ' SER . 19.3 m -72.45 -23.66 61.09 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 111.683 0.253 . . . . 1.54 111.683 -174.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.928 ' HA ' HD23 ' A' ' 8' ' ' LEU . 6.3 p30 -65.16 -22.43 66.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.763 0.316 . . . . 1.78 110.434 175.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.637 ' HB2' ' O ' ' A' ' 3' ' ' GLN . 0.6 OUTLIER -58.55 -53.15 61.59 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 115.949 -0.569 . . . . 1.8999999999999999 110.133 173.89 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.539 ' CD ' ' HG ' ' A' ' 43' ' ' SER . 36.9 mt-10 -56.23 -49.11 75.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.184 -0.916 . . . . 0.68000000000000005 110.733 -178.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.928 HD23 ' HA ' ' A' ' 5' ' ' ASN . 0.6 OUTLIER -47.49 -44.19 25.2 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.499 -0.773 . . . . 1.8 111.056 176.385 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.407 HG13 HD11 ' A' ' 13' ' ' LEU . 72.9 t -70.79 -64.05 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.296 0.57 . . . . 1.0700000000000001 110.548 175.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 6' ' ' ARG . 48.8 t -51.83 -48.49 38.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 114.906 -1.043 . . . . 1.1299999999999999 112.676 -174.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -56.03 -38.06 70.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.291 -0.413 . . . . 0.58999999999999997 110.679 -178.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.639 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 47.6 t80 -74.33 -45.01 50.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.136 -0.483 . . . . 2.02 110.964 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.701 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.8 mp -57.67 -44.06 85.49 Favored 'General case' 0 C--N 1.338 0.083 0 C-N-CA 120.386 -0.525 . . . . 1.0600000000000001 109.846 178.514 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 m -58.48 -40.47 82.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.47 0.652 . . . . 1.6000000000000001 110.675 177.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -73.67 -17.99 61.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.299 -0.864 . . . . 1.49 111.215 -174.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.637 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.0 mmpt? -88.52 -47.75 8.09 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-O 121.5 0.667 . . . . 1.8400000000000001 110.32 -178.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.593 HD21 ' SG ' ' A' ' 111' ' ' CYS . 13.4 mt -57.41 -30.8 65.25 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 115.258 -0.883 . . . . 1.98 111.335 177.492 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.5 t -57.24 -47.78 80.49 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.112 -0.495 . . . . 1.3799999999999999 111.409 177.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -74.14 1.4 11.29 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.931 0.396 . . . . 1.51 111.854 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.661 ' HE2' HG11 ' A' ' 112' ' ' VAL . 15.3 mmmt -110.49 -26.74 9.34 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.953 0.883 . . . . 2.6499999999999999 109.172 178.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.72 26.3 7.23 Favored Glycine 0 N--CA 1.443 -0.833 0 CA-C-N 114.014 -1.448 . . . . 0.54000000000000004 111.921 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -122.59 167.19 13.7 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.851 0.358 . . . . 1.1200000000000001 110.831 174.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.9 t -110.55 151.19 27.9 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.897 -0.592 . . . . 0.75 110.003 177.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -72.67 -51.1 20.85 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.08 -0.509 . . . . 4.29 109.759 172.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.1 p -61.72 -40.61 95.69 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.68 -0.691 . . . . 1.8600000000000001 111.596 -171.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -55.74 -31.0 62.15 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.103 0.478 . . . . 1.52 111.33 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -114.14 16.05 18.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.937 -0.574 . . . . 1.53 111.125 -176.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.602 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 59.8 p -100.97 -179.68 4.12 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.739 0.781 . . . . 2.04 112.359 -175.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.588 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 6.9 t70 -163.91 -24.44 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 113.934 -1.485 . . . . 2.3100000000000001 108.142 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.635 HG21 ' H ' ' A' ' 31' ' ' GLU . 9.9 m -57.91 -72.88 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 113.884 -1.507 . . . . 1.4099999999999999 112.874 -177.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.635 ' H ' HG21 ' A' ' 30' ' ' VAL . 14.5 mm-40 -86.59 -0.05 55.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.543 -0.91 . . . . 2.7400000000000002 108.543 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.588 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.1 tt0 -73.3 -58.25 3.44 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.663 -1.153 . . . . 1.45 110.182 178.575 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.54 HD21 ' HG2' ' A' ' 32' ' ' GLU . 0.9 OUTLIER -81.85 -51.55 8.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.712 -0.676 . . . . 1.8700000000000001 110.827 -176.017 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.6 ptp180 -102.5 144.42 30.97 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.228 0.537 . . . . 3.8199999999999998 110.41 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 14.8 p -129.83 110.95 12.13 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.633 -0.712 . . . . 2.6699999999999999 109.953 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -122.38 -67.33 0.96 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.714 -0.676 . . . . 3.3399999999999999 111.046 -173.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.414 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . . . -63.33 137.38 97.06 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.736 -0.665 . . . . 2.4399999999999999 111.491 179.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.753 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 50.6 Cg_exo -58.48 -178.09 0.11 Allowed 'Trans proline' 0 CA--C 1.529 0.227 0 C-N-CA 123.41 2.74 . . . . 1.8700000000000001 112.022 173.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -74.36 -11.38 60.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.22 0.533 . . . . 4.6399999999999997 110.361 178.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 160.54 70.97 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.883 0 N-CA-C 111.115 -0.794 . . . . 2.3999999999999999 111.115 178.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.83 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.5 t -71.9 -74.66 0.15 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 120.78 -0.368 . . . . 1.45 110.586 -174.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.83 ' H ' HG23 ' A' ' 41' ' ' THR . 12.8 pt-20 -93.1 -29.99 15.49 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 122.545 1.164 . . . . 2.02 108.692 168.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.632 ' HA ' HG12 ' A' ' 46' ' ' VAL . 3.7 p -60.06 -27.13 66.71 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 112.717 -2.038 . . . . 1.25 113.599 -170.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -46.17 -54.15 9.2 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 111.8 0.296 . . . . 1.9099999999999999 111.8 -176.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.99 -41.76 61.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.555 0.217 . . . . 1.1799999999999999 111.521 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.632 HG12 ' HA ' ' A' ' 43' ' ' SER . 0.5 OUTLIER -70.19 -37.15 70.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.896 -0.322 . . . . 2.0099999999999998 111.29 -174.787 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.56 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 8.4 ptpt -68.12 -36.38 79.63 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.4 -0.963 . . . . 1.3799999999999999 108.4 176.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.473 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 3.8 mm100 -63.79 -38.84 92.61 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.195 -0.911 . . . . 0.98999999999999999 110.619 178.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.622 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -74.0 -41.38 61.97 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.183 0.516 . . . . 1.1399999999999999 110.632 176.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.466 HD23 ' HA ' ' A' ' 50' ' ' LEU . 0.1 OUTLIER -54.6 -43.53 72.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.092 -0.958 . . . . 1.95 111.687 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.56 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 7.9 ptp180 -74.58 -26.16 59.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.179 0.514 . . . . 2.5099999999999998 110.026 -170.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 5.3 mm-40 -74.17 -51.46 15.44 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.898 -1.046 . . . . 1.1000000000000001 110.077 178.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.32 -42.13 99.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.517 -0.765 . . . . 1.04 110.19 177.075 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.596 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -64.74 -38.29 95.43 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.584 -0.735 . . . . 0.69999999999999996 111.95 176.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.421 ' HA ' ' OE2' ' A' ' 58' ' ' GLU . 14.7 t70 -57.59 -54.14 50.2 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 122.337 0.255 . . . . 1.04 110.496 177.039 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.52 ' HA ' HD12 ' A' ' 59' ' ' LEU . 48.0 mt-10 -56.99 -27.72 61.72 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 123.847 0.717 . . . . 2.29 111.569 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.451 ' CD1' HD12 ' B' 1015 ' ' ILE . 75.2 t80 -72.98 -30.67 63.98 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.929 -0.578 . . . . 2.9300000000000002 110.921 177.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.596 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 41.0 mt-10 -70.47 -70.27 0.31 Allowed 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 112.18 0.437 . . . . 1.3 112.18 -173.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.672 HD21 ' N ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -55.6 -34.52 64.93 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.083 0.468 . . . . 2.1899999999999999 111.457 -174.661 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.672 ' N ' HD21 ' A' ' 59' ' ' LEU . 7.3 ttm180 -53.04 -66.39 0.39 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.337 -0.847 . . . . 3.1400000000000001 111.676 176.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.451 ' OH ' ' O ' ' B' 1011 ' ' PHE . 40.3 m-85 -94.22 -0.23 55.27 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.161 0.8 . . . . 5.5899999999999999 113.161 -172.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.473 ' HA ' ' CD2' ' A' ' 65' ' ' PHE . 3.0 tmt_? -43.69 -38.41 3.11 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.38 0.672 . . . . 4.9299999999999997 112.272 -176.272 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 67.1 mtt180 -46.39 -50.36 16.68 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.111 0.481 . . . . 5.3499999999999996 110.551 176.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.457 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -71.91 -47.76 50.34 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 115.609 -0.723 . . . . 1.7 110.854 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.473 ' CD2' ' HA ' ' A' ' 62' ' ' ARG . 17.9 m-85 -45.9 -48.65 16.12 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.905 0.706 . . . . 3.52 112.905 -172.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.403 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 27.8 t -62.46 -38.28 89.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.111 0.481 . . . . 2.5899999999999999 110.894 -177.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -81.21 -31.58 33.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.183 0.516 . . . . 2.7200000000000002 110.479 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.457 HD13 ' O ' ' A' ' 64' ' ' ALA . 1.8 mp -60.64 -17.66 48.65 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.309 -0.859 . . . . 2.25 112.296 -177.225 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.727 HG22 HG13 ' A' ' 74' ' ' ILE . 3.4 p -55.83 -25.43 41.79 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.165 0.439 . . . . 1.26 110.926 177.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.5 t -74.35 -37.24 63.56 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.266 0.555 . . . . 1.8 109.535 175.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -72.36 -40.89 67.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.321 -0.854 . . . . 1.8899999999999999 110.37 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.457 HD21 ' O ' ' A' ' 68' ' ' LEU . 3.1 mm? -68.25 -34.31 75.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.641 -0.503 . . . . 1.98 109.641 170.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.419 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 85.9 t60 71.11 0.76 3.54 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.586 -0.734 . . . . 3.54 109.844 -171.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.727 HG13 HG22 ' A' ' 69' ' ' THR . 31.6 mm 20.12 -85.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 126.0 1.72 . . . . 1.1499999999999999 114.256 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.89 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER 23.14 -160.87 0.0 OUTLIER Pre-proline 0 CA--C 1.588 2.423 0 C-N-CA 125.033 1.333 . . . . 1.1200000000000001 113.513 -173.927 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.89 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 76.2 Cg_exo -28.13 165.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 125.267 3.978 . . . . 0.53000000000000003 117.281 169.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -34.68 -20.9 0.01 OUTLIER Glycine 0 C--N 1.347 1.153 0 N-CA-C 117.627 1.811 . . . . 0.40999999999999998 117.627 -173.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.438 ' N ' ' O ' ' A' ' 76' ' ' PRO . 38.2 p -66.69 0.91 2.04 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 117.97 0.885 . . . . 1.22 111.481 178.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.476 ' HA ' ' OG ' ' A' ' 82' ' ' SER . . . -67.91 -14.72 63.19 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.987 -0.552 . . . . 1.0700000000000001 110.272 172.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -78.31 -21.01 50.29 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.367 -0.605 . . . . 4.3099999999999996 109.367 176.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.53 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 41.9 mt-30 -81.86 -25.87 34.71 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.006 0.908 . . . . 1.03 109.387 172.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.476 ' OG ' ' HA ' ' A' ' 79' ' ' ALA . 2.3 m -72.23 -54.22 10.26 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.344 -1.298 . . . . 0.47999999999999998 109.743 173.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.466 ' HE2' ' CE1' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -62.41 -19.5 63.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.887 -1.051 . . . . 1.4399999999999999 110.213 176.21 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.586 ' HA ' HG12 ' A' ' 87' ' ' VAL . 37.2 tt0 -63.39 -51.6 65.17 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.043 -0.981 . . . . 0.80000000000000004 111.027 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -50.03 -33.05 16.94 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.076 -0.965 . . . . 1.99 110.82 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.665 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -83.13 -51.65 14.19 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.04 0 CA-C-N 114.605 -1.179 . . . . 1.8999999999999999 110.725 -177.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.586 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.8 p -61.64 -22.38 28.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.888 0.851 . . . . 1.4299999999999999 109.378 -178.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.576 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.7 m-80 -68.07 -51.72 43.35 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 114.142 -1.39 . . . . 0.91000000000000003 110.912 173.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.958 ' HB2' ' HB3' ' B' 1009 ' ' ALA . 0.9 OUTLIER -65.45 -37.31 86.5 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 121.763 0.792 . . . . 2.8700000000000001 108.872 -178.932 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.61 ' HG ' ' CD ' ' A' ' 89' ' ' GLU . 21.1 mt -67.17 -19.22 65.55 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 113.907 -1.497 . . . . 1.9199999999999999 112.591 -167.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.721 ' HA ' HG21 ' A' ' 95' ' ' VAL . 2.7 p90 -109.94 -19.7 13.01 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.78 -0.368 . . . . 2.9700000000000002 111.878 -174.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.576 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.0 OUTLIER -100.98 -22.53 14.74 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.255 -0.578 . . . . 5.6699999999999999 111.253 -177.984 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -96.15 21.19 9.18 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.822 -0.626 . . . . 3.1200000000000001 111.345 -169.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 112.82 67.62 0.51 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 118.291 -1.909 . . . . 2.3100000000000001 114.059 175.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.721 HG21 ' HA ' ' A' ' 91' ' ' PHE . 38.8 t -70.33 95.63 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.465 0 CA-C-O 122.67 1.224 . . . . 1.6799999999999999 110.928 -177.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.641 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 0.2 OUTLIER -110.2 179.21 4.16 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 113.095 -1.866 . . . . 2.1200000000000001 107.252 167.618 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.6 ' HB3' ' CD2' ' A' ' 151' ' ' PHE . 12.7 m-90 -51.87 -44.06 63.55 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 123.411 0.444 . . . . 4.1200000000000001 111.529 -176.278 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -62.71 -33.14 85.89 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 114.662 0.625 . . . . 0.80000000000000004 114.662 -176.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.641 ' HG2' ' ND2' ' A' ' 96' ' ' ASN . 81.5 mmt-85 -60.93 -38.72 86.79 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 117.632 0.716 . . . . 4.9100000000000001 110.38 -178.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.597 HG12 ' HG ' ' A' ' 138' ' ' LEU . 81.4 mt -75.17 -35.4 34.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 115.196 -0.911 . . . . 1.1100000000000001 111.281 -173.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.4 m -65.88 -33.78 65.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.549 -0.537 . . . . 2.0299999999999998 109.549 173.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.51 -48.04 71.05 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.218 0.532 . . . . 1.0600000000000001 109.603 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.466 ' CE1' ' HE2' ' A' ' 83' ' ' PHE . 42.8 t80 -50.48 -53.2 31.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.47 -1.241 . . . . 1.8400000000000001 111.931 178.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.529 ' HA ' ' HE2' ' A' ' 130' ' ' MET . 0.2 OUTLIER -80.08 -20.23 45.63 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.395 -0.522 . . . . 4.21 111.081 -175.027 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.639 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 31.3 t -75.01 -53.02 9.65 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.63 0.252 . . . . 1.55 110.382 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.497 ' CZ ' ' HB ' ' A' ' 86' ' ' VAL . 2.3 p90 -68.23 -22.08 64.8 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 109.599 -0.519 . . . . 3.6400000000000001 109.599 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.461 ' HA2' ' HB2' ' A' ' 110' ' ' LEU . . . -75.07 -40.87 33.67 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.687 -0.768 . . . . 0.32000000000000001 111.507 174.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.701 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -64.57 -33.98 88.69 Favored Glycine 0 N--CA 1.448 -0.5 0 N-CA-C 110.916 -0.874 . . . . 0.23999999999999999 110.916 174.246 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.95 -29.23 58.22 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.532 -0.334 . . . . 1.05 110.449 173.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.461 ' HB2' ' HA2' ' A' ' 107' ' ' GLY . 0.2 OUTLIER -62.73 -39.67 94.79 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 107.758 -1.201 . . . . 1.78 107.758 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.731 ' HG ' HG13 ' A' ' 123' ' ' VAL . 41.1 t -48.69 -60.32 2.82 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 113.362 -1.744 . . . . 0.90000000000000002 109.554 171.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.744 ' HA ' HG11 ' A' ' 115' ' ' VAL . 46.0 t -66.38 -31.65 54.54 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 CA-C-N 116.366 -0.379 . . . . 1.2 111.859 -178.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.537 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 22.5 mt-10 -57.52 -20.72 33.42 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 118.28 0.491 . . . . 2.5099999999999998 110.321 176.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.506 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 50.1 m -89.54 -44.93 9.76 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 108.465 -0.939 . . . . 0.28000000000000003 108.465 179.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.744 HG11 ' HA ' ' A' ' 112' ' ' VAL . 1.4 m -67.86 -29.07 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.106 0 CA-C-N 115.061 -0.972 . . . . 1.8300000000000001 109.623 -177.069 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -51.56 -50.62 59.73 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 113.379 -1.737 . . . . 0.59999999999999998 111.169 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.413 ' CG ' ' HE1' ' A' ' 119' ' ' MET . 31.5 mmtt -86.15 13.57 7.65 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.695 -0.684 . . . . 2.1600000000000001 109.811 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.57 ' HA ' HE21 ' A' ' 120' ' ' GLN . 23.9 mm-40 63.57 53.54 2.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 122.016 0.912 . . . . 1.8799999999999999 110.571 -177.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.464 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 27.1 mtm -132.27 39.83 3.37 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.197 -1.365 . . . . 1.0800000000000001 107.457 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.638 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 3.9 mp0 -53.54 -6.82 0.08 Allowed 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 114.685 -1.143 . . . . 1.1499999999999999 113.18 -178.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.561 HG21 HD22 ' A' ' 122' ' ' LEU . 21.1 m -67.71 -29.01 43.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.588 -0.695 . . . . 1.1899999999999999 111.973 175.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.561 HD22 HG21 ' A' ' 121' ' ' VAL . 3.8 mm? -65.06 -27.27 68.67 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.02 0.438 . . . . 1.0600000000000001 110.294 178.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.731 HG13 ' HG ' ' A' ' 111' ' ' CYS . 39.8 t -44.13 -46.4 2.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 114.384 -1.28 . . . . 1.0 112.165 -177.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.602 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 23.0 t -73.83 -43.28 59.22 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.325 -0.398 . . . . 1.6599999999999999 111.743 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.421 ' O ' ' HD1' ' A' ' 129' ' ' TRP . 8.6 ptm180 -72.24 -36.87 69.19 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.966 -0.293 . . . . 3.2999999999999998 110.264 -170.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.607 HD11 ' HA ' ' A' ' 111' ' ' CYS . 82.4 mt -55.45 -49.58 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.642 -0.254 . . . . 1.0600000000000001 111.323 174.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.561 ' HB1' HD22 ' A' ' 13' ' ' LEU . . . -58.2 -30.5 66.51 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.767 0.318 . . . . 1.1000000000000001 111.478 -178.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.09 -60.66 3.28 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.395 0.617 . . . . 1.1200000000000001 110.193 175.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.421 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 98.5 m95 -57.75 -41.8 82.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.648 -1.16 . . . . 4.7699999999999996 111.045 -178.071 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.529 ' HE2' ' HA ' ' A' ' 104' ' ' PHE . 87.5 mtp -59.11 -57.74 11.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.457 -0.338 . . . . 1.0900000000000001 111.416 -178.247 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.1 74.87 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.872 -0.331 . . . . 1.05 110.87 -177.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.408 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 22.4 m -68.02 -45.18 74.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.852 0.358 . . . . 1.1299999999999999 111.458 176.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.6 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 13.0 m-85 -63.78 -33.29 75.33 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.896 -0.321 . . . . 3.3500000000000001 110.422 177.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.794 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.7 tt -64.43 -50.95 65.58 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 108.354 -0.98 . . . . 1.5900000000000001 108.354 170.079 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . 0.503 ' OD1' ' HB3' ' A' ' 2' ' ' SER . 2.3 m-80 -49.02 -60.83 2.44 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.651 0.611 . . . . 0.46000000000000002 112.651 -179.366 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -78.51 -44.91 23.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.931 0.396 . . . . 0.58999999999999997 111.941 -172.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . 0.6 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 14.5 m80 -90.54 -51.41 5.41 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.857 0.688 . . . . 2.3399999999999999 112.857 -170.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.794 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -85.37 -47.07 10.35 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 113.932 1.086 . . . . 1.8999999999999999 113.932 -168.844 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.675 ' HA ' HD11 ' A' ' 142' ' ' ILE . 37.7 tt0 -45.48 -52.72 21.56 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 112.891 0.7 . . . . 0.75 112.891 -173.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.569 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 51.5 Cg_exo -53.44 -48.97 19.08 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.717 1.612 . . . . 0.87 111.522 177.023 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -61.26 -46.1 91.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.332 -0.849 . . . . 1.4299999999999999 110.339 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.675 HD11 ' HA ' ' A' ' 139' ' ' GLU . 37.5 mt -48.46 -51.25 11.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.073 0.464 . . . . 1.1299999999999999 111.117 175.264 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.582 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 74.7 mm-40 -59.14 -32.92 70.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.453 -0.794 . . . . 0.57999999999999996 111.485 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.569 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 12.3 mm-40 -64.59 -21.13 66.62 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.585 0.707 . . . . 0.78000000000000003 110.871 177.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -106.76 11.86 29.75 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.0 -1.0 . . . . 0.93000000000000005 109.54 -175.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 113.62 -35.02 4.73 Favored Glycine 0 N--CA 1.439 -1.122 0 CA-C-N 114.525 -1.216 . . . . 0.56000000000000005 112.895 174.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 124.46 -170.86 16.57 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.664 -0.779 . . . . 0.48999999999999999 111.691 -177.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.532 ' NE1' HD13 ' A' ' 142' ' ' ILE . 4.4 m-90 -78.54 -33.46 47.84 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.565 0.221 . . . . 4.5199999999999996 111.099 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -65.28 -41.71 93.88 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.922 0.391 . . . . 1.96 110.309 178.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.464 ' O ' ' HB2' ' A' ' 153' ' ' GLU . 88.2 m -56.94 -35.85 69.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.868 -0.605 . . . . 1.24 111.197 177.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.6 ' CD2' ' HB3' ' A' ' 97' ' ' TRP . 53.5 t80 -58.92 -41.97 88.58 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.216 -0.447 . . . . 3.7200000000000002 110.552 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.551 HG11 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -72.81 -25.75 22.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.098 0.475 . . . . 1.8600000000000001 110.304 -179.039 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 150' ' ' THR . 62.0 mm-40 -60.81 -23.21 64.88 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.033 0.444 . . . . 1.6699999999999999 110.551 173.272 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.514 ' HB2' ' CD1' ' A' ' 155' ' ' TYR . 0.5 OUTLIER -105.5 -54.27 2.51 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.887 -0.597 . . . . 1.96 110.956 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . 0.514 ' CD1' ' HB2' ' A' ' 154' ' ' LEU . 88.8 m-85 -110.61 14.51 22.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.643 -0.708 . . . . 4.3899999999999997 111.242 -171.153 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.622 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -59.76 158.93 23.2 Favored Glycine 0 CA--C 1.504 -0.643 0 C-N-CA 121.251 -0.5 . . . . 1.1000000000000001 113.629 -175.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -48.73 108.87 0.2 Allowed 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 113.94 -1.13 . . . . 1.29 110.947 178.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.682 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 3.9 m120 -76.26 -26.49 56.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.382 -0.372 . . . . 3.4399999999999999 111.912 -174.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -55.08 -48.15 73.92 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.895 0.378 . . . . 2.6699999999999999 110.743 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -75.0 -37.01 61.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.099 -0.5 . . . . 2.8700000000000001 110.788 176.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 0.468 ' HB2' ' HA ' ' A' ' 158' ' ' ASN . . . -58.25 -56.2 25.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.969 -0.56 . . . . 3.2000000000000002 111.596 -178.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.682 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 10.6 pt-20 -66.22 -25.22 66.81 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.53 0.205 . . . . 3.7200000000000002 111.218 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.4 t -68.37 -47.31 67.72 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 109.605 -0.517 . . . . 4.2000000000000002 109.605 -179.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -77.86 -17.74 57.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.501 0.667 . . . . 6.3700000000000001 110.276 177.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.489 ' HB3' ' HA ' ' A' ' 162' ' ' GLU . 41.3 ttmt -76.87 -37.78 54.92 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.209 -0.905 . . . . 5.0099999999999998 109.796 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -62.71 -39.19 97.63 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.317 -0.856 . . . . 5.0999999999999996 112.617 -178.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -74.63 -23.19 58.65 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 122.496 -0.414 . . . . 5.9400000000000004 110.387 178.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -74.23 -13.98 60.86 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.766 -0.652 . . . . 5.8799999999999999 109.362 175.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.513 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 4.2 tmt_? -92.05 -29.3 16.65 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.201 -0.909 . . . . 7.7999999999999998 108.686 178.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.425 HD22 ' HA ' ' A' ' 170' ' ' LEU . 0.3 OUTLIER -87.83 -59.54 2.22 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.442 -0.799 . . . . 7.29 109.401 -174.53 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -83.04 124.27 30.27 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.081 -0.711 . . . . 6.9699999999999998 109.081 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -96.32 117.75 31.46 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.861 0.362 . . . . 9.8100000000000005 110.301 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -75.43 -5.67 46.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.833 -0.621 . . . . 11.99 112.062 -174.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -75.88 96.42 3.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.898 0.38 . . . . 11.949999999999999 110.399 177.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -101.47 -41.44 6.63 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.285 -0.635 . . . . 14.949999999999999 109.285 175.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -170.16 -77.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.504 -0.771 . . . . 15.880000000000001 109.769 175.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . 0.411 ' HB3' HD23 ' A' ' 178' ' ' LEU . 26.5 m170 45.1 -100.96 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.692 0.62 . . . . 16.02 112.218 -177.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.411 HD23 ' HB3' ' A' ' 177' ' ' HIS . 2.5 pt? -137.28 152.32 49.66 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.963 -0.384 . . . . 18.210000000000001 109.963 -179.066 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -110.72 153.93 24.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.0 -0.545 . . . . 19.219999999999999 110.656 -177.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -80.58 150.68 29.45 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.551 -0.537 . . . . 22.800000000000001 109.551 178.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -87.87 122.06 31.04 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.042 0.448 . . . . 22.510000000000002 110.864 -178.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 42.4 t-80 -96.56 -12.1 24.49 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.646 -0.707 . . . . 25.300000000000001 109.585 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -80.03 126.79 31.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.718 -0.674 . . . . 25.77 109.746 174.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 21.9 t60 -91.72 -20.58 21.41 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.047 0.451 . . . . 27.370000000000001 109.922 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 40.7 m80 . . . . . 0 C--O 1.247 0.946 0 CA-C-O 118.455 -0.783 . . . . 29.52 110.015 179.132 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.291 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B 1002 ' ' GLY . . . . . 0.536 ' O ' ' H1 ' ' B' 1100 ' ' 33B . . . 72.68 54.05 7.79 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.873 -0.679 . . . . 2.9900000000000002 111.545 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.488 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . 25.4 m -125.9 -149.52 0.42 Allowed 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 110.379 -0.23 . . . . 1.9399999999999999 110.379 -177.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.962 HG23 ' H ' ' B' 1005 ' ' GLY . 14.8 m 52.63 -92.87 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 124.548 1.139 . . . . 1.9399999999999999 112.571 174.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 0.962 ' H ' HG23 ' B' 1004 ' ' VAL . . . -46.23 -25.39 1.87 Allowed Glycine 0 CA--C 1.532 1.14 0 CA-C-N 119.914 1.234 . . . . 1.26 113.037 165.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 1006 ' ' ARG . . . . . 0.452 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 10.3 mpt_? -85.32 -47.8 9.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.103 0.478 . . . . 3.4500000000000002 111.165 171.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 1007 ' ' ALA . . . . . 0.624 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . . . -82.68 -52.74 6.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.829 -0.623 . . . . 1.54 112.543 -168.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.505 HD22 ' HA ' ' B' 1004 ' ' VAL . 3.9 mm? -59.58 -58.56 8.04 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 123.172 0.295 . . . . 1.8999999999999999 110.542 -176.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 0.958 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . . . -32.35 -53.63 0.31 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 122.186 0.993 . . . . 1.45 112.059 170.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.862 ' HB2' ' N11' ' B' 1100 ' ' 33B . . . -68.69 -55.19 12.23 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 113.816 -1.538 . . . . 1.51 111.877 -176.199 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.607 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 48.9 m-85 -64.7 -23.27 67.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.199 -0.455 . . . . 2.0699999999999998 111.048 -178.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 1012 ' ' GLY . . . . . 0.455 ' O ' HD13 ' B' 1015 ' ' ILE . . . -72.19 -6.66 65.39 Favored Glycine 0 N--CA 1.446 -0.669 0 CA-C-N 116.006 -0.543 . . . . 0.80000000000000004 112.831 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -80.87 -2.26 46.69 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 111.757 0.28 . . . . 1.8999999999999999 111.757 177.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 2.4 m -112.32 24.11 12.91 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 121.793 -0.567 . . . . 1.4399999999999999 111.419 -174.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.455 HD13 ' O ' ' B' 1012 ' ' GLY . 1.7 mp -76.26 104.56 4.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.925 0.393 . . . . 3.4300000000000002 111.243 -178.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 1016 ' ' ASN . . . . . 0.404 ' HB3' ' HE2' ' A' ' 155' ' ' TYR . 24.3 t-20 57.64 88.19 0.06 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.224 -0.898 . . . . 4.79 112.086 172.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -153.06 -78.29 0.11 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.034 -0.53 . . . . 8.9800000000000004 110.419 179.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 116.611 -0.268 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.862 ' N11' ' HB2' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.5 ttp . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 120.963 0.411 . . . . 6.4500000000000002 110.039 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.8 m -99.61 113.0 25.15 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.241 0.543 . . . . 2.2599999999999998 110.596 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.626 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 43.7 tp60 -71.84 -7.18 46.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.264 0.554 . . . . 2.7599999999999998 109.69 178.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.782 ' HB3' ' HB3' ' A' ' 38' ' ' PRO . 63.5 p -76.33 -16.21 59.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.805 -0.634 . . . . 1.54 110.249 177.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.734 ' HA ' HD21 ' A' ' 8' ' ' LEU . 51.5 m-20 -66.81 -19.82 65.82 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.462 -0.57 . . . . 1.78 109.462 175.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.626 ' HB2' ' O ' ' A' ' 3' ' ' GLN . 2.5 mmt85 -51.01 -51.02 57.22 Favored 'General case' 0 CA--C 1.509 -0.607 0 CA-C-N 115.417 -0.811 . . . . 1.8999999999999999 110.522 176.257 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.428 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 43.5 mt-10 -56.38 -47.2 79.42 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.172 -0.922 . . . . 0.68000000000000005 111.163 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.734 HD21 ' HA ' ' A' ' 5' ' ' ASN . 1.2 mp -51.44 -31.58 23.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.508 -0.769 . . . . 1.8 111.21 176.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.444 HG21 ' CA ' ' A' ' 131' ' ' ALA . 77.9 t -83.1 -67.05 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.55 0.691 . . . . 1.0700000000000001 110.531 172.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 6' ' ' ARG . 51.1 t -50.28 -55.26 6.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.656 -1.156 . . . . 1.1299999999999999 113.515 -172.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -50.73 -33.33 22.55 Favored 'General case' 0 C--O 1.234 0.246 0 O-C-N 123.635 0.584 . . . . 0.58999999999999997 111.364 -174.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.65 ' HE1' ' HB3' ' A' ' 51' ' ' ARG . 98.9 m-85 -90.37 -35.57 15.12 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.838 -0.619 . . . . 2.02 112.37 -175.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 1.022 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 2.6 mp -60.12 -37.57 80.41 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 119.368 -0.933 . . . . 1.0600000000000001 108.93 174.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.424 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 39.8 t -58.75 -44.98 90.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.278 -0.873 . . . . 1.6000000000000001 110.68 175.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -66.9 -33.92 76.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.072 -0.513 . . . . 1.49 110.702 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.616 ' HG2' ' O ' ' A' ' 12' ' ' PHE . 8.5 mmpt? -68.97 -33.24 73.37 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.434 -0.348 . . . . 1.8400000000000001 110.962 -178.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.621 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -73.2 -30.02 63.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.876 0.37 . . . . 1.98 110.434 176.447 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.6 t -62.44 -36.15 81.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.911 -0.586 . . . . 1.3799999999999999 111.4 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -77.07 -1.91 31.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 1.51 111.664 -179.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.574 ' HE2' HG12 ' A' ' 112' ' ' VAL . 15.6 mmmt -111.75 -26.21 9.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.872 0.844 . . . . 2.6499999999999999 109.227 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.69 23.14 8.96 Favored Glycine 0 N--CA 1.441 -0.982 0 CA-C-N 113.978 -1.465 . . . . 0.54000000000000004 111.719 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.417 ' HE2' HE21 ' A' ' 120' ' ' GLN . 50.0 m-85 -113.66 164.69 13.36 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.023 -0.362 . . . . 1.1200000000000001 110.023 175.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.587 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 2.1 t -111.57 143.68 42.06 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.975 -0.557 . . . . 0.75 109.833 176.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.451 ' HZ2' ' HB2' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -66.5 -48.75 68.82 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.229 -0.441 . . . . 4.29 110.117 174.631 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.465 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 3.9 p -64.36 -27.84 69.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.5 . . . . 1.8600000000000001 111.919 -174.237 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.587 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 94.7 mt-30 -57.36 -33.65 68.01 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.203 0.525 . . . . 1.52 110.989 176.006 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -120.09 14.86 12.34 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.604 -0.726 . . . . 1.53 111.319 -170.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.563 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 72.5 p -100.98 179.89 4.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 122.074 0.94 . . . . 2.04 112.94 -172.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.626 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 21.4 t70 -168.69 -20.28 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 113.182 -1.827 . . . . 2.3100000000000001 107.933 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.652 HG22 ' H ' ' A' ' 31' ' ' GLU . 5.8 m -57.51 -71.8 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 114.171 -1.377 . . . . 1.4099999999999999 112.669 -176.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.652 ' H ' HG22 ' A' ' 30' ' ' VAL . 24.2 mm-40 -87.82 -2.92 58.92 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.668 -0.864 . . . . 2.7400000000000002 108.668 177.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.626 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 34.6 tt0 -76.27 -41.18 49.71 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.6 -1.182 . . . . 1.45 109.378 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.468 ' ND2' ' HG2' ' A' ' 32' ' ' GLU . 34.4 m-80 -135.8 90.21 2.57 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.218 -0.901 . . . . 1.8700000000000001 109.341 177.347 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.538 ' HB3' ' O ' ' A' ' 30' ' ' VAL . 10.2 ptm180 -147.24 -174.87 4.63 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-O 121.753 0.787 . . . . 3.8199999999999998 112.526 -175.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.1 p -67.54 -179.91 1.19 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.045 -1.434 . . . . 2.6699999999999999 112.187 174.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.53 ' HG3' ' H ' ' A' ' 37' ' ' ALA . 6.0 pt-20 -77.03 -111.57 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.212 -1.358 . . . . 3.3399999999999999 112.343 -178.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.53 ' H ' ' HG3' ' A' ' 36' ' ' GLU . . . -97.99 150.04 36.34 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-N 114.996 -1.002 . . . . 2.4399999999999999 112.283 -172.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.782 ' HB3' ' HB3' ' A' ' 4' ' ' SER . 24.1 Cg_exo -64.15 159.55 42.53 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 123.455 2.77 . . . . 1.8700000000000001 112.299 171.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -87.45 6.56 33.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.782 0.801 . . . . 4.6399999999999997 109.833 173.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.567 ' O ' ' HG2' ' A' ' 42' ' ' GLU . . . -173.63 71.84 0.1 OUTLIER Glycine 0 N--CA 1.445 -0.749 0 CA-C-N 114.885 -1.052 . . . . 2.3999999999999999 110.582 -176.025 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.651 HG21 ' HB2' ' A' ' 38' ' ' PRO . 1.5 p -72.79 13.91 0.33 Allowed 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 123.959 0.904 . . . . 1.45 113.19 -172.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.567 ' HG2' ' O ' ' A' ' 40' ' ' GLY . 10.4 pt-20 -29.3 -32.55 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.713 1.205 . . . . 2.02 113.454 169.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.706 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 2.7 p -30.74 -49.03 0.12 Allowed 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 114.228 1.196 . . . . 1.25 114.228 -177.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -40.27 -50.93 2.76 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.748 0.648 . . . . 1.9099999999999999 112.748 -173.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.39 -36.38 58.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.697 0.284 . . . . 1.1799999999999999 111.519 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.607 ' HA ' HG12 ' A' ' 152' ' ' VAL . 1.0 OUTLIER -74.25 -39.05 49.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.632 -0.258 . . . . 2.0099999999999998 111.344 -175.011 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.706 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.0 ptpt -67.37 -44.43 78.97 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.993 -0.743 . . . . 1.3799999999999999 108.993 174.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.443 ' H ' ' HG3' ' A' ' 47' ' ' LYS . 3.6 mm100 -54.12 -35.18 61.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.724 -0.671 . . . . 0.98999999999999999 112.038 174.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.57 ' HB1' ' HA2' ' A' ' 156' ' ' GLY . . . -80.66 -30.94 36.52 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.105 0.479 . . . . 1.1399999999999999 111.036 177.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.597 ' HG ' ' CE2' ' A' ' 104' ' ' PHE . 1.1 mp -68.34 -26.92 65.84 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.707 -0.679 . . . . 1.95 111.744 -176.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.65 ' HB3' ' HE1' ' A' ' 12' ' ' PHE . 5.3 ptp180 -80.83 -26.6 36.95 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.57 0.7 . . . . 2.5099999999999998 109.26 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -71.5 -54.33 10.92 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.592 -1.186 . . . . 1.1000000000000001 109.707 177.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.36 -39.31 93.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.724 -0.671 . . . . 1.04 110.454 176.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.698 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -58.22 -51.92 55.66 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.666 -0.697 . . . . 0.69999999999999996 112.003 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.549 ' O ' HD23 ' A' ' 59' ' ' LEU . 17.8 t70 -53.33 -40.89 65.2 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.956 0.408 . . . . 1.04 111.226 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.503 ' O ' HD21 ' A' ' 59' ' ' LEU . 44.2 mt-10 -75.27 -25.34 57.93 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.453 -0.794 . . . . 2.29 111.645 -179.018 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.891 ' HZ ' ' HA2' ' B' 1012 ' ' GLY . 8.0 t80 -85.38 -46.95 10.46 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.74 0.644 . . . . 2.9300000000000002 112.74 178.456 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.698 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 44.8 mt-10 -54.86 -52.12 63.81 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.737 0.643 . . . . 1.3 112.737 -166.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.549 HD23 ' O ' ' A' ' 55' ' ' ASP . 2.2 pt? -52.15 -34.25 43.94 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.196 -0.911 . . . . 2.1899999999999999 111.697 -174.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 -55.35 -55.15 34.81 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.466 -0.334 . . . . 3.1400000000000001 111.154 -178.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.598 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 47.4 p90 -93.03 -3.58 54.09 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.242 -0.435 . . . . 5.5899999999999999 111.775 -178.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.611 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 41.6 ttm180 -50.87 -36.04 35.78 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.746 0.647 . . . . 4.9299999999999997 112.746 -173.113 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -61.81 -31.59 71.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.605 0.24 . . . . 5.3499999999999996 111.512 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.622 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.06 -47.8 7.6 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.567 0.58 . . . . 1.7 112.567 -174.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.611 ' CD1' ' HA ' ' A' ' 62' ' ' ARG . 5.7 p90 -58.47 -27.09 64.09 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.703 0.631 . . . . 3.52 112.703 -166.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.0 t -70.58 -31.59 68.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.151 0.5 . . . . 2.5899999999999999 110.259 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -91.01 -24.96 19.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 2.7200000000000002 111.008 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 59.9 mt -59.76 -16.69 29.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.915 0.709 . . . . 2.25 112.915 -174.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.643 HG21 HG13 ' A' ' 74' ' ' ILE . 16.6 p -50.91 -35.89 35.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.113 0.482 . . . . 1.26 111.113 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 13.4 t -67.01 -34.72 78.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.402 -0.817 . . . . 1.8 110.755 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.448 HE22 ' HB2' ' B' 1003 ' ' CYS . 7.9 mt-30 -78.54 -49.06 13.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.776 -0.647 . . . . 1.8899999999999999 110.289 -177.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.695 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.1 mt -67.06 -30.64 70.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.397 -0.819 . . . . 1.98 110.196 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.1 m80 68.58 61.31 0.36 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.922 0.868 . . . . 3.54 109.191 -177.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.643 HG13 HG21 ' A' ' 69' ' ' THR . 16.0 mm -64.93 123.54 17.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 114.009 -1.45 . . . . 1.1499999999999999 110.926 -178.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.775 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.1 -169.35 0.22 Allowed Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 107.515 -1.291 . . . . 1.1200000000000001 107.515 -169.872 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.775 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.5 Cg_exo -30.5 166.26 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.272 0 C-N-CA 124.722 3.614 . . . . 0.53000000000000003 114.875 164.69 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.24 -28.93 0.01 OUTLIER Glycine 0 N--CA 1.476 1.331 0 N-CA-C 117.089 1.596 . . . . 0.40999999999999998 117.089 -175.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.455 ' N ' ' O ' ' A' ' 76' ' ' PRO . 22.1 p -69.27 6.53 0.97 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 117.693 0.747 . . . . 1.22 111.695 178.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.3 -14.23 62.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.391 -0.596 . . . . 1.0700000000000001 109.391 169.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -75.48 -16.81 60.27 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.649 -0.705 . . . . 4.3099999999999996 109.348 174.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.468 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 76.5 mt-30 -83.8 -27.01 29.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.947 0.879 . . . . 1.03 109.635 173.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.695 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.8 m -72.1 -52.45 16.74 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.646 -1.161 . . . . 0.47999999999999998 109.187 171.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.449 ' HB2' ' HG ' ' A' ' 110' ' ' LEU . 75.6 t80 -65.03 -16.1 63.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.887 -1.051 . . . . 1.4399999999999999 110.005 174.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.651 ' HA ' HG13 ' A' ' 87' ' ' VAL . 34.1 tt0 -62.95 -50.14 71.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.975 0.416 . . . . 0.80000000000000004 110.288 176.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -44.32 -45.55 8.8 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 114.793 -1.094 . . . . 1.99 111.343 179.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.63 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.4 p -90.44 -39.21 11.79 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 CA-C-N 113.42 -1.718 . . . . 1.8999999999999999 111.77 -171.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.651 HG13 ' HA ' ' A' ' 84' ' ' GLU . 5.3 p -64.86 -23.4 33.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.894 0.854 . . . . 1.4299999999999999 109.063 176.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.1 m-80 -70.49 -46.09 64.4 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.309 -1.314 . . . . 0.91000000000000003 111.345 175.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 1.008 ' HB2' ' HB3' ' B' 1009 ' ' ALA . 0.7 OUTLIER -69.14 -36.4 77.41 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 108.59 -0.893 . . . . 2.8700000000000001 108.59 -179.222 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 86' ' ' VAL . 1.1 tp -69.58 -20.16 63.65 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 113.797 -1.547 . . . . 1.9199999999999999 111.783 -168.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.586 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 2.5 p90 -110.66 -12.3 14.34 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.441 -0.503 . . . . 2.9700000000000002 111.569 -175.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.552 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 9.0 ptm180 -98.46 -35.47 10.25 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.388 0.613 . . . . 5.6699999999999999 110.988 -179.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -82.93 5.05 23.24 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.323 -0.853 . . . . 3.1200000000000001 112.587 -167.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 131.26 67.49 0.1 OUTLIER Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 117.83 -2.129 . . . . 2.3100000000000001 114.724 -177.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.586 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 57.3 t -72.71 95.86 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 122.056 0.931 . . . . 1.6799999999999999 111.307 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -113.19 -171.0 1.79 Allowed 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.425 -1.261 . . . . 2.1200000000000001 108.868 173.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.646 ' HB3' ' HE2' ' A' ' 155' ' ' TYR . 15.7 m-90 -53.39 -54.23 39.77 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 123.475 0.484 . . . . 4.1200000000000001 111.345 -179.544 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.776 ' HA3' HG22 ' B' 1015 ' ' ILE . . . -77.17 -16.59 80.47 Favored Glycine 0 CA--C 1.52 0.381 0 C-N-CA 121.093 -0.575 . . . . 0.80000000000000004 113.775 -175.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.619 HH12 ' HA ' ' B' 1009 ' ' ALA . 7.5 tpp180 -67.36 -43.02 82.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.066 0.46 . . . . 4.9100000000000001 110.464 -178.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 85.5 mt -69.86 -31.78 49.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.3 0.572 . . . . 1.1100000000000001 110.488 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.612 ' HA ' ' CD2' ' A' ' 104' ' ' PHE . 59.8 t -52.96 -51.72 35.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.35 -0.841 . . . . 2.0299999999999998 110.352 172.42 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.31 -47.61 75.36 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.657 -0.701 . . . . 1.0600000000000001 110.841 175.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -57.32 -50.71 72.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.315 -0.857 . . . . 1.8400000000000001 112.357 -178.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.612 ' CD2' ' HA ' ' A' ' 101' ' ' VAL . 1.2 p90 -66.86 -36.18 81.73 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 120.584 -0.446 . . . . 4.21 110.404 -176.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 44.5 m -68.4 -40.73 81.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.253 -0.43 . . . . 1.55 110.501 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -71.56 -34.52 70.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.883 -0.599 . . . . 3.6400000000000001 110.402 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.494 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -62.49 -42.01 99.74 Favored Glycine 0 N--CA 1.444 -0.823 0 C-N-CA 120.367 -0.921 . . . . 0.32000000000000001 110.89 174.271 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 1.022 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.29 -28.32 73.43 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.788 -0.72 . . . . 0.23999999999999999 111.683 174.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.97 -35.12 50.59 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.907 -0.172 . . . . 1.05 110.636 176.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.449 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -59.64 -38.81 82.39 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 107.904 -1.146 . . . . 1.78 107.904 178.411 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.708 ' SG ' HG21 ' A' ' 123' ' ' VAL . 26.2 t -49.14 -63.12 1.19 Allowed 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 113.406 -1.725 . . . . 0.90000000000000002 109.824 171.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.757 ' HA ' HG13 ' A' ' 115' ' ' VAL . 42.5 t -62.27 -34.52 64.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 1.2 111.667 -177.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.503 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 32.8 mt-10 -57.0 -23.51 46.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.055 0.455 . . . . 2.5099999999999998 110.278 178.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 54.3 m -85.93 -43.62 13.07 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 108.479 -0.934 . . . . 0.28000000000000003 108.479 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.757 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.8 m -69.0 -29.04 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 CA-C-N 114.93 -1.032 . . . . 1.8300000000000001 109.787 -176.055 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -50.53 -49.93 54.49 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 113.165 -1.834 . . . . 0.59999999999999998 110.995 174.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.442 ' CG ' ' HE1' ' A' ' 119' ' ' MET . 33.9 mmtt -86.81 11.19 13.8 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.554 -0.748 . . . . 2.1600000000000001 110.019 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 64.03 52.75 1.98 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 122.146 0.974 . . . . 1.8799999999999999 110.137 -175.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.442 ' HE1' ' CG ' ' A' ' 117' ' ' LYS . 30.3 mtm -129.9 36.92 4.0 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.075 -1.42 . . . . 1.0800000000000001 107.531 179.118 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.742 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 11.7 mp0 -53.84 -7.95 0.15 Allowed 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.637 -1.165 . . . . 1.1499999999999999 113.24 -178.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.541 HG22 HD22 ' A' ' 122' ' ' LEU . 20.9 m -67.06 -20.51 27.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 O-C-N 121.671 -0.643 . . . . 1.1899999999999999 111.997 175.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.685 HD11 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -75.05 -25.07 58.38 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.029 0.442 . . . . 1.0600000000000001 110.077 177.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.708 HG21 ' SG ' ' A' ' 111' ' ' CYS . 42.3 t -45.52 -51.87 2.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.617 -1.174 . . . . 1.0 112.355 -177.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.563 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 7.1 t -75.24 -34.27 61.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.884 0.374 . . . . 1.6599999999999999 110.76 -178.38 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.685 ' HD2' HD11 ' A' ' 122' ' ' LEU . 74.2 mtt180 -64.06 -51.39 64.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.445 . . . . 3.2999999999999998 110.591 -176.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.549 HD11 ' HA ' ' A' ' 111' ' ' CYS . 73.4 mt -53.97 -50.05 56.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.572 -0.74 . . . . 1.0600000000000001 111.155 178.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -53.73 -36.11 61.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.893 0.378 . . . . 1.1000000000000001 111.517 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.5 -56.99 13.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.555 0.693 . . . . 1.1200000000000001 110.674 176.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -65.31 -32.01 73.44 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.809 -1.087 . . . . 4.7699999999999996 111.334 -176.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.543 ' SD ' HD11 ' A' ' 13' ' ' LEU . 90.3 mtp -64.51 -54.29 34.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.907 0.384 . . . . 1.0900000000000001 111.277 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.444 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -61.69 -41.02 97.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.027 -0.533 . . . . 1.05 111.151 -178.026 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 59.7 m -65.73 -43.24 89.65 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.808 -0.357 . . . . 1.1299999999999999 110.782 176.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.597 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 16.7 t80 -56.64 -40.11 74.88 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.707 -0.479 . . . . 3.3500000000000001 109.707 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.847 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.2 tt -61.1 -55.91 27.08 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.827 -0.805 . . . . 1.5900000000000001 108.827 172.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -50.63 -46.86 58.5 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.388 -0.823 . . . . 0.46000000000000002 112.862 -176.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -87.03 -47.43 8.94 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.127 0.489 . . . . 0.58999999999999997 111.8 -174.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . 0.597 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 66.8 m-70 -90.17 -50.89 5.74 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.829 -0.623 . . . . 2.3399999999999999 112.253 -170.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.847 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -85.07 -44.84 12.66 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 113.555 0.946 . . . . 1.8999999999999999 113.555 -168.52 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.649 ' HA ' HD13 ' A' ' 142' ' ' ILE . 29.6 tt0 -45.18 -51.25 25.41 Favored Pre-proline 0 C--N 1.32 -0.701 0 O-C-N 123.699 0.625 . . . . 0.75 112.596 -174.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.567 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 46.5 Cg_exo -55.7 -47.67 24.15 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 121.673 1.582 . . . . 0.87 111.591 175.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . 0.452 ' O ' ' HB2' ' A' ' 144' ' ' GLU . 0.1 OUTLIER -57.43 -48.18 79.83 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.507 -0.77 . . . . 1.4299999999999999 110.387 177.586 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.649 HD13 ' HA ' ' A' ' 139' ' ' GLU . 19.1 mt -51.54 -49.43 33.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.665 -0.698 . . . . 1.1299999999999999 111.531 175.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.618 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 80.5 mm-40 -60.98 -29.71 69.84 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.773 -0.649 . . . . 0.57999999999999996 111.263 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.567 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 13.2 mm-40 -64.57 -20.17 66.08 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 121.439 0.637 . . . . 0.78000000000000003 110.571 174.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.627 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -105.83 3.58 28.84 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.279 -0.873 . . . . 0.93000000000000005 109.517 -175.56 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.15 -30.47 6.76 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.157 -0.929 . . . . 0.56000000000000005 113.229 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . 0.414 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 113.42 159.72 13.65 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.252 -0.739 . . . . 0.48999999999999999 111.252 -175.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.513 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 81.4 m95 -55.74 -30.77 61.75 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.491 0.552 . . . . 4.5199999999999996 112.491 -174.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.506 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 14.1 p-10 -63.32 -41.29 98.91 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.669 -0.412 . . . . 1.96 109.955 177.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.544 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 54.3 m -65.94 -32.53 74.08 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.841 -0.618 . . . . 1.24 110.768 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.722 ' HD2' ' HH ' ' A' ' 155' ' ' TYR . 4.1 m-85 -60.28 -41.94 94.4 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.004 -0.544 . . . . 3.7200000000000002 110.13 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.607 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -77.09 -25.28 15.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.155 0.503 . . . . 1.8600000000000001 110.233 177.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.506 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 8.9 mm-40 -58.74 -20.82 52.68 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 121.967 -0.458 . . . . 1.6699999999999999 110.124 173.11 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 150' ' ' THR . 2.6 mt -99.36 -55.62 2.63 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.884 -0.598 . . . . 1.96 110.419 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . 0.722 ' HH ' ' HD2' ' A' ' 151' ' ' PHE . 26.8 p90 -121.89 30.24 6.74 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.626 0.727 . . . . 4.3899999999999997 112.402 -173.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.57 ' HA2' ' HB1' ' A' ' 49' ' ' ALA . . . -66.52 163.58 42.96 Favored Glycine 0 C--N 1.303 -1.291 0 CA-C-N 114.804 -1.089 . . . . 1.1000000000000001 113.738 -177.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -53.03 114.88 1.6 Allowed 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 113.604 -1.298 . . . . 1.29 112.088 -177.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.666 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 7.5 m120 -73.71 -28.13 61.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.058 -0.519 . . . . 3.4399999999999999 111.983 -176.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -54.38 -46.29 73.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.105 0.478 . . . . 2.6699999999999999 110.431 178.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -76.68 -37.06 56.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.665 -0.698 . . . . 2.8700000000000001 110.656 175.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 0.552 ' HB2' ' HA ' ' A' ' 158' ' ' ASN . . . -55.88 -61.37 2.42 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.189 -0.459 . . . . 3.2000000000000002 111.396 -179.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.666 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 12.6 pt-20 -57.73 -35.51 70.79 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.623 0.249 . . . . 3.7200000000000002 111.458 178.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 46.0 t -61.22 -45.15 95.76 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.006 0.431 . . . . 4.2000000000000002 110.639 -177.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 11.9 mpt_? -84.42 -11.29 56.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.158 -0.473 . . . . 6.3700000000000001 110.79 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -89.35 -33.66 16.81 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.916 -0.584 . . . . 5.0099999999999998 110.42 -178.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -61.1 -30.66 74.25 Favored Glycine 0 N--CA 1.447 -0.572 0 CA-C-N 115.846 -0.615 . . . . 5.0999999999999996 112.943 -177.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -79.18 -14.06 59.32 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.975 0.417 . . . . 5.9400000000000004 110.618 178.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . 0.544 ' HA ' ' HG2' ' A' ' 171' ' ' GLU . 37.2 mt-10 -90.43 4.93 49.56 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.043 -0.526 . . . . 5.8799999999999999 110.352 177.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.503 ' HG3' HD22 ' A' ' 170' ' ' LEU . 19.3 tpp180 -62.68 -46.83 86.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.807 -0.633 . . . . 7.7999999999999998 110.119 178.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.503 HD22 ' HG3' ' A' ' 169' ' ' ARG . 3.0 mm? -130.25 -24.97 2.51 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.842 -0.617 . . . . 7.29 110.238 177.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . 0.544 ' HG2' ' HA ' ' A' ' 168' ' ' GLU . 50.2 mt-10 63.57 -174.13 0.16 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.412 -0.813 . . . . 6.9699999999999998 111.429 177.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 74.8 m80 -106.03 165.1 11.45 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.124 -0.695 . . . . 9.8100000000000005 109.124 175.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -70.98 -41.35 71.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.132 0.492 . . . . 11.99 109.676 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -83.97 87.79 7.13 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.606 0.717 . . . . 11.949999999999999 109.549 172.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . 0.474 ' O ' ' HB2' ' A' ' 176' ' ' HIS . 33.6 t-80 -94.29 -34.07 12.98 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.851 -0.613 . . . . 14.949999999999999 110.572 -177.366 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . 0.474 ' HB2' ' O ' ' A' ' 175' ' ' HIS . 29.3 m80 73.4 135.43 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 O-C-N 124.006 0.816 . . . . 15.880000000000001 111.399 -177.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -155.67 155.0 32.43 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.283 -0.871 . . . . 16.02 109.303 -178.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 178' ' ' LEU . 3.9 mm? -72.52 93.56 1.59 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.019 0.438 . . . . 18.210000000000001 111.119 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.69 -27.7 66.2 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.917 -0.771 . . . . 19.219999999999999 108.917 173.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 59.2 m80 -126.74 90.98 3.26 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.996 -1.002 . . . . 22.800000000000001 109.522 173.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 11.1 p80 -89.13 137.81 31.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.798 -0.637 . . . . 22.510000000000002 111.138 -177.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 58.19 84.06 0.11 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.603 -0.726 . . . . 25.300000000000001 111.38 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -74.93 -34.32 62.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.593 -0.73 . . . . 25.77 110.581 178.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 17.4 p80 -131.96 134.25 45.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.241 0.543 . . . . 27.370000000000001 110.565 -179.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.406 -0.806 . . . . 29.52 110.161 -177.374 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.187 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -87.58 -66.92 1.32 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.778 -0.725 . . . . 2.9900000000000002 111.764 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.448 ' HB2' HE22 ' A' ' 71' ' ' GLN . 4.6 m 62.83 -148.85 0.35 Allowed 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 122.599 0.359 . . . . 1.9399999999999999 110.913 177.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.719 ' HA ' ' CD1' ' B' 1008 ' ' LEU . 0.3 OUTLIER 39.69 -88.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.34 0.188 0 O-C-N 124.682 1.239 . . . . 1.9399999999999999 113.682 176.349 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . -34.32 -35.04 0.04 OUTLIER Glycine 0 CA--C 1.536 1.389 0 O-C-N 123.395 0.434 . . . . 1.26 113.981 166.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -107.21 -44.73 4.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 117.329 0.564 . . . . 3.4500000000000002 112.446 175.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1007 ' ' ALA . . . . . 0.456 ' HB1' HD11 ' B' 1008 ' ' LEU . . . -58.57 -64.24 1.0 Allowed 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 113.046 0.758 . . . . 1.54 113.046 -165.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.719 ' CD1' ' HA ' ' B' 1004 ' ' VAL . 4.3 mp -71.0 -36.09 72.33 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-N 116.514 -0.312 . . . . 1.8999999999999999 110.352 -172.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 1.008 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . . . -42.28 -45.21 4.12 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.38 -0.827 . . . . 1.45 110.245 168.515 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.79 ' HB2' ' C13' ' B' 1100 ' ' 33B . . . -77.16 -40.41 45.54 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.463 -1.244 . . . . 1.51 111.681 -178.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.501 ' CE1' ' H14' ' B' 1100 ' ' 33B . 39.2 m-85 -74.6 -30.27 61.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.784 0.326 . . . . 2.0699999999999998 111.312 -177.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B 1012 ' ' GLY . . . . . 0.891 ' HA2' ' HZ ' ' A' ' 57' ' ' PHE . . . -71.63 -11.45 72.81 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 116.07 -0.514 . . . . 0.80000000000000004 112.79 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.88 -17.11 60.63 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.171 0.51 . . . . 1.8999999999999999 110.311 174.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 9.4 m -86.55 73.24 10.12 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.291 0.567 . . . . 1.4399999999999999 110.304 -178.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.776 HG22 ' HA3' ' A' ' 98' ' ' GLY . 6.4 pt -132.58 39.8 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.321 -0.854 . . . . 3.4300000000000002 109.337 176.023 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 17.0 m120 -106.36 -12.56 15.63 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.933 -1.031 . . . . 4.79 110.415 -175.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -107.35 91.25 3.58 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.68 -0.691 . . . . 8.9800000000000004 110.323 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.502 0 CA-C-N 116.557 -0.292 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.79 ' C13' ' HB2' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.5 ttp . . . . . 0 N--CA 1.48 1.042 0 CA-C-O 120.556 0.217 . . . . 6.4500000000000002 110.775 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.8 p -135.57 -49.27 0.71 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.588 0.232 . . . . 2.2599999999999998 111.41 -176.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -70.04 -1.76 10.79 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.966 0.358 . . . . 2.7599999999999998 111.966 -174.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -60.1 -24.35 64.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.133 -0.485 . . . . 1.54 111.273 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.505 ' HB2' HD13 ' A' ' 134' ' ' LEU . 6.2 p30 -57.45 -30.08 64.73 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.898 -0.592 . . . . 1.78 111.601 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.517 ' HB3' ' HB3' ' A' ' 37' ' ' ALA . 18.5 tpp85 -55.51 -49.92 71.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.895 -0.593 . . . . 1.8999999999999999 110.959 178.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.573 ' OE1' ' HA2' ' A' ' 40' ' ' GLY . 42.8 mt-10 -60.71 -43.13 98.21 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.679 -0.691 . . . . 0.68000000000000005 111.596 -176.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.8 mt -63.3 -34.84 78.57 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.237 -0.892 . . . . 1.8 109.534 -175.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 53.4 t -68.63 -63.83 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 115.51 -0.768 . . . . 1.0700000000000001 109.586 173.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.485 HG21 ' O ' ' A' ' 6' ' ' ARG . 97.9 t -49.55 -55.06 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.371 -0.831 . . . . 1.1299999999999999 113.033 -176.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -57.66 -33.25 68.12 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.201 0.313 . . . . 0.58999999999999997 111.067 -173.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.653 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 20.4 t80 -83.64 -39.32 20.41 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 120.573 -0.451 . . . . 2.02 111.464 -177.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.989 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.0 mp -58.04 -40.34 80.68 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 119.666 -0.813 . . . . 1.0600000000000001 109.286 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.43 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 47.8 t -60.08 -41.72 93.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.428 -0.806 . . . . 1.6000000000000001 110.548 175.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -66.08 -30.47 70.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.908 -0.587 . . . . 1.49 110.935 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.815 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 14.8 mmmt -73.05 -48.67 34.0 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 121.453 0.644 . . . . 1.8400000000000001 109.852 -178.378 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.575 HD21 ' SG ' ' A' ' 111' ' ' CYS . 10.8 mt -56.54 -33.27 65.92 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.516 -0.765 . . . . 1.98 111.002 172.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.8 t -68.23 -24.81 64.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.876 -0.602 . . . . 1.3799999999999999 111.893 -178.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.815 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 23.2 pt20 -77.18 -16.65 59.02 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-O 121.395 0.617 . . . . 1.51 110.304 -177.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.71 ' HZ1' HG12 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -105.04 -24.62 12.78 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.943 -1.026 . . . . 2.6499999999999999 109.365 -179.364 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.04 23.14 8.74 Favored Glycine 0 N--CA 1.439 -1.115 0 CA-C-N 114.189 -1.369 . . . . 0.54000000000000004 112.936 176.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -99.22 164.58 12.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.737 0.304 . . . . 1.1200000000000001 110.295 172.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.1 t -103.22 148.28 25.99 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.145 0.497 . . . . 0.75 110.671 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.629 ' HH2' ' HB3' ' A' ' 127' ' ' ALA . 58.3 t-105 -75.53 -54.26 7.29 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.433 -0.803 . . . . 4.29 109.557 174.509 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.1 m -62.4 -32.8 73.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.703 -0.68 . . . . 1.8600000000000001 111.948 -173.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -60.29 -28.83 68.4 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 111.921 0.341 . . . . 1.52 111.921 -178.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -117.27 -2.44 11.61 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.222 0.453 . . . . 1.53 112.222 -175.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.613 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 51.5 m -102.04 155.48 18.15 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-O 122.155 0.978 . . . . 2.04 113.181 -175.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -130.79 -0.22 4.29 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 113.321 -1.763 . . . . 2.3100000000000001 109.163 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.679 HG22 ' H ' ' A' ' 31' ' ' GLU . 4.9 m -59.99 -75.68 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.434 -1.257 . . . . 1.4099999999999999 113.239 -167.32 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.679 ' H ' HG22 ' A' ' 30' ' ' VAL . 33.1 mm-40 -92.03 -2.9 56.44 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.679 -0.859 . . . . 2.7400000000000002 108.679 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -64.08 -41.97 97.13 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.717 -1.129 . . . . 1.45 110.711 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -101.26 -53.9 2.91 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.517 -0.765 . . . . 1.8700000000000001 110.731 -175.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.546 ' O ' ' HA ' ' A' ' 31' ' ' GLU . 17.6 ptt180 -113.48 133.55 55.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.051 0.453 . . . . 3.8199999999999998 110.538 176.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.6 p -96.45 107.31 19.69 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.735 -0.666 . . . . 2.6699999999999999 110.345 179.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -95.31 -66.35 0.92 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.38 -0.827 . . . . 3.3399999999999999 111.415 -173.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.517 ' HB3' ' HB3' ' A' ' 6' ' ' ARG . . . -92.92 154.45 41.9 Favored Pre-proline 0 C--N 1.317 -0.829 0 CA-C-N 115.672 -0.695 . . . . 2.4399999999999999 111.334 -177.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.529 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 27.2 Cg_exo -63.39 -176.87 0.33 Allowed 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.323 2.682 . . . . 1.8700000000000001 112.426 177.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -81.08 9.71 6.3 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.307 0.575 . . . . 4.6399999999999997 110.509 179.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.573 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 130.04 72.87 0.13 Allowed Glycine 0 N--CA 1.441 -1.014 0 N-CA-C 110.991 -0.843 . . . . 2.3999999999999999 110.991 -176.186 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.864 HG22 ' H ' ' A' ' 42' ' ' GLU . 1.8 t -76.6 -77.35 0.14 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 120.369 -0.533 . . . . 1.45 110.371 -175.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.864 ' H ' HG22 ' A' ' 41' ' ' THR . 11.1 pt-20 -94.08 -30.44 14.66 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 123.011 1.386 . . . . 2.02 107.783 165.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.529 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.0 OUTLIER -60.86 -25.66 66.83 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 112.135 -2.302 . . . . 1.25 113.43 -171.245 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -53.08 -51.36 62.07 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 120.758 0.313 . . . . 1.9099999999999999 110.635 179.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.516 ' HB1' HG22 ' A' ' 152' ' ' VAL . . . -74.62 -35.6 62.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.07 0.462 . . . . 1.1799999999999999 110.212 178.301 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.682 ' HA ' ' CG1' ' A' ' 152' ' ' VAL . 95.1 t -58.91 -60.42 2.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.295 -0.866 . . . . 2.0099999999999998 111.372 179.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.577 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 11.6 ptpt -59.36 -35.57 74.15 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.258 -0.645 . . . . 1.3799999999999999 109.258 -178.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.702 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -66.63 -30.33 70.58 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.404 -0.817 . . . . 0.98999999999999999 110.654 -179.616 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.74 ' HB3' ' HA2' ' A' ' 156' ' ' GLY . . . -83.5 -38.46 21.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.243 0.544 . . . . 1.1399999999999999 110.463 176.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.503 HD12 ' CE2' ' A' ' 151' ' ' PHE . 0.8 OUTLIER -65.88 -27.31 68.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.382 -0.827 . . . . 1.95 111.576 -176.368 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.702 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 6.4 ptp180 -81.41 -24.11 37.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.385 0.612 . . . . 2.5099999999999998 109.494 -178.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -75.49 -44.97 41.15 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.927 -1.033 . . . . 1.1000000000000001 109.271 174.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.78 -43.58 95.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.512 -0.767 . . . . 1.04 109.885 173.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.637 ' O ' ' HG2' ' A' ' 58' ' ' GLU . . . -65.73 -32.82 84.21 Favored Glycine 0 C--O 1.221 -0.663 0 CA-C-N 115.356 -0.838 . . . . 0.69999999999999996 112.058 177.301 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -57.96 -48.02 81.22 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.842 -0.429 . . . . 1.04 109.842 178.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -66.42 -27.33 67.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.339 -0.846 . . . . 2.29 111.17 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.609 ' CE2' ' HA ' ' A' ' 102' ' ' ALA . 5.4 t80 -80.76 -27.86 36.64 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.32 -0.4 . . . . 2.9300000000000002 111.47 -178.222 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.637 ' HG2' ' O ' ' A' ' 54' ' ' GLY . 36.9 mm-40 -49.82 -69.04 0.13 Allowed 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 112.216 0.451 . . . . 1.3 112.216 -178.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.747 HD22 ' N ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -53.98 -35.45 61.84 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.248 -0.887 . . . . 2.1899999999999999 111.343 -179.443 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.747 ' N ' HD22 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -51.63 -62.07 1.85 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.607 -0.724 . . . . 3.1400000000000001 112.33 175.681 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.446 ' HD1' ' HB3' ' A' ' 65' ' ' PHE . 31.1 p90 -90.98 -11.41 39.01 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 112.022 0.378 . . . . 5.5899999999999999 112.022 -175.444 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.741 ' HG3' ' HE1' ' A' ' 65' ' ' PHE . 43.0 ttm180 -62.38 -29.72 70.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.674 0.273 . . . . 4.9299999999999997 111.277 -175.806 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -64.84 -35.14 80.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.345 -0.389 . . . . 5.3499999999999996 110.622 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.424 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -91.52 -50.4 5.8 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.396 0.517 . . . . 1.7 112.396 -176.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.944 ' HA ' ' HB2' ' A' ' 68' ' ' LEU . 1.3 p90 -57.59 -27.32 62.61 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 112.581 0.586 . . . . 3.52 112.581 -166.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.6 p -64.29 -33.35 75.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.01 0.433 . . . . 2.5899999999999999 110.539 177.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -90.28 -32.45 16.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.496 0.665 . . . . 2.7200000000000002 109.738 174.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.944 ' HB2' ' HA ' ' A' ' 65' ' ' PHE . 3.3 mp -60.1 -19.73 54.79 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-N 115.205 -0.907 . . . . 2.25 112.506 -177.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.651 HG21 HG13 ' A' ' 74' ' ' ILE . 1.3 p -58.15 -28.43 64.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 118.29 0.496 . . . . 1.26 111.114 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 21.8 t -71.53 -37.3 71.19 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 109.365 -0.606 . . . . 1.8 109.365 173.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.453 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 13.2 mt-30 -68.44 -40.18 81.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.432 -0.804 . . . . 1.8899999999999999 110.088 178.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.491 HD22 ' O ' ' A' ' 68' ' ' LEU . 3.0 mm? -68.72 -32.56 72.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.609 -0.269 . . . . 1.98 110.64 172.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.5 m80 60.84 49.23 6.19 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.476 -0.935 . . . . 3.54 108.476 -170.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.651 HG13 HG21 ' A' ' 69' ' ' THR . 33.1 mm -51.3 113.05 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 113.805 -1.543 . . . . 1.1499999999999999 112.325 -176.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.778 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -154.55 -172.93 0.34 Allowed Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 107.522 -1.288 . . . . 1.1200000000000001 107.522 -171.804 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.778 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.4 Cg_exo -29.91 166.28 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.332 0 C-N-CA 125.185 3.923 . . . . 0.53000000000000003 115.466 166.224 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.513 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -29.26 -31.2 0.01 OUTLIER Glycine 0 N--CA 1.472 1.048 0 N-CA-C 117.307 1.683 . . . . 0.40999999999999998 117.307 -173.233 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 76' ' ' PRO . 18.2 p -66.14 2.03 1.3 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 117.653 0.726 . . . . 1.22 112.243 -179.065 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.25 -12.46 61.69 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.182 0.515 . . . . 1.0700000000000001 110.012 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.513 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 5.5 p90 -73.58 -21.76 60.25 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 109.212 -0.662 . . . . 4.3099999999999996 109.212 175.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.441 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 37.4 mt-30 -80.82 -25.58 37.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.867 0.841 . . . . 1.03 109.553 175.186 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.9 m -71.34 -51.67 22.96 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 114.482 -1.235 . . . . 0.47999999999999998 109.524 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.577 ' HE1' ' HB2' ' A' ' 106' ' ' PHE . 78.5 t80 -68.87 -18.65 64.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.057 -0.974 . . . . 1.4399999999999999 110.467 176.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.61 ' HA ' HG11 ' A' ' 87' ' ' VAL . 37.4 tt0 -59.51 -49.25 78.5 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.391 -0.822 . . . . 0.80000000000000004 110.339 176.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.458 ' OE1' HG22 ' B' 1004 ' ' VAL . 66.1 mt-30 -48.45 -32.6 7.99 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.805 -1.089 . . . . 1.99 110.737 176.089 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.773 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -83.83 -53.07 11.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.803 -1.09 . . . . 1.8999999999999999 110.815 -177.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.61 HG11 ' HA ' ' A' ' 84' ' ' GLU . 7.6 p -61.44 -23.92 32.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.492 0.663 . . . . 1.4299999999999999 109.602 -179.057 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.686 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.6 m-80 -68.47 -52.77 28.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.581 -1.191 . . . . 0.91000000000000003 111.102 174.11 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.908 ' HB2' ' HB3' ' B' 1009 ' ' ALA . 0.8 OUTLIER -63.22 -36.54 83.98 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 121.881 0.848 . . . . 2.8700000000000001 108.762 -178.303 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.625 ' HG ' ' CD ' ' A' ' 89' ' ' GLU . 19.1 mt -68.89 -22.35 64.19 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 113.731 -1.577 . . . . 1.9199999999999999 112.527 -167.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.717 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 5.6 p90 -106.79 -32.11 8.1 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 120.494 -0.483 . . . . 2.9700000000000002 111.842 -174.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.686 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.0 OUTLIER -81.54 -24.41 36.62 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.243 0.544 . . . . 5.6699999999999999 110.854 -172.689 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.47 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 0.4 OUTLIER -98.53 18.52 16.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.518 -0.764 . . . . 3.1200000000000001 112.713 -170.249 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 116.19 68.88 0.42 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 117.829 -2.129 . . . . 2.3100000000000001 114.756 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.717 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 63.5 t -70.49 105.39 1.42 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 CA-C-N 118.276 1.038 . . . . 1.6799999999999999 111.277 -176.293 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.442 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 3.5 p30 -110.12 -170.66 1.69 Allowed 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 113.675 -1.602 . . . . 2.1200000000000001 108.229 172.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.817 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 23.2 m-90 -62.86 -35.06 78.73 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.84 0.352 . . . . 4.1200000000000001 110.633 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -73.75 -38.47 50.05 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.996 -0.547 . . . . 0.80000000000000004 113.697 -176.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.442 ' HG2' ' ND2' ' A' ' 96' ' ' ASN . 16.1 mmt180 -54.19 -31.74 53.75 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.225 0.536 . . . . 4.9100000000000001 111.563 -178.515 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.431 HG12 ' HG ' ' A' ' 138' ' ' LEU . 78.9 mt -83.19 -34.16 10.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.954 -0.566 . . . . 1.1100000000000001 111.653 -174.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.449 ' HA ' ' CD1' ' A' ' 104' ' ' PHE . 1.1 m -66.93 -25.97 35.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 109.344 -0.613 . . . . 2.0299999999999998 109.344 171.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.609 ' HA ' ' CE2' ' A' ' 57' ' ' PHE . . . -68.5 -51.87 38.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.194 0.521 . . . . 1.0600000000000001 109.71 172.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -49.37 -54.56 16.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.5 -1.227 . . . . 1.8400000000000001 111.936 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.888 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 0.3 OUTLIER -73.49 -19.08 61.03 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 120.645 -0.422 . . . . 4.21 111.441 -172.844 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.653 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 67.9 m -77.31 -49.27 15.35 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.509 0.195 . . . . 1.55 110.653 177.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.642 ' CZ ' HD13 ' B' 1008 ' ' LEU . 19.2 m-85 -60.51 -39.55 88.18 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 110.092 -0.336 . . . . 3.6400000000000001 110.092 177.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.879 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.99 -38.98 94.63 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.875 -0.678 . . . . 0.32000000000000001 111.959 177.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.989 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.6 -40.8 99.04 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.612 -0.804 . . . . 0.23999999999999999 111.362 175.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.13 -32.2 66.71 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.771 0.32 . . . . 1.05 110.76 177.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.524 ' HB3' HD12 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -58.31 -39.89 80.58 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 108.377 -0.972 . . . . 1.78 108.377 179.48 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.742 ' SG ' HG21 ' A' ' 123' ' ' VAL . 40.1 t -51.25 -64.11 0.92 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 113.713 -1.585 . . . . 0.90000000000000002 110.247 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.71 HG12 ' HZ1' ' A' ' 20' ' ' LYS . 44.6 t -61.57 -37.17 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-N 116.508 -0.314 . . . . 1.2 111.826 -175.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.499 ' HG3' ' CG2' ' A' ' 69' ' ' THR . 4.0 mm-40 -60.21 -21.81 62.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.105 0.479 . . . . 2.5099999999999998 110.67 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.415 ' HB2' ' O ' ' A' ' 111' ' ' CYS . 70.3 m -83.74 -42.77 16.19 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 108.061 -1.088 . . . . 0.28000000000000003 108.061 179.071 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.709 ' HA ' ' HG3' ' A' ' 120' ' ' GLN . 1.6 m -68.9 -28.79 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-N 114.796 -1.093 . . . . 1.8300000000000001 109.515 -177.44 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -51.67 -51.03 59.1 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 113.26 -1.791 . . . . 0.59999999999999998 110.919 174.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.436 ' CG ' ' HE2' ' A' ' 119' ' ' MET . 15.5 mmtp -84.7 13.92 5.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.523 -0.762 . . . . 2.1600000000000001 110.285 179.22 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 65.31 46.12 2.71 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.95 0.881 . . . . 1.8799999999999999 109.976 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.439 ' HE1' ' HB2' ' A' ' 119' ' ' MET . 26.8 mtm -126.7 38.24 4.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.559 -1.201 . . . . 1.0800000000000001 107.889 -178.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.709 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 10.2 mp0 -54.68 -8.05 0.21 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 114.775 -1.102 . . . . 1.1499999999999999 113.048 -179.367 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.588 HG23 HD21 ' A' ' 122' ' ' LEU . 16.5 m -64.0 -27.56 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 O-C-N 121.831 -0.543 . . . . 1.1899999999999999 111.477 174.051 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.588 HD21 HG23 ' A' ' 121' ' ' VAL . 3.2 mm? -70.04 -25.48 63.58 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 110.235 -0.284 . . . . 1.0600000000000001 110.235 178.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.742 HG21 ' SG ' ' A' ' 111' ' ' CYS . 55.2 t -47.7 -51.38 7.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.587 -0.733 . . . . 1.0 111.819 -178.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.613 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 14.6 t -75.62 -31.48 59.89 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.881 0.372 . . . . 1.6599999999999999 110.598 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.5 ' O ' ' HD1' ' A' ' 129' ' ' TRP . 58.6 mtp180 -66.42 -55.25 16.66 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 116.205 -0.452 . . . . 3.2999999999999998 110.418 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.537 HD13 ' HA ' ' A' ' 111' ' ' CYS . 87.7 mt -53.64 -42.82 52.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.591 -0.731 . . . . 1.0600000000000001 111.799 -175.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.629 ' HB3' ' HH2' ' A' ' 24' ' ' TRP . . . -60.27 -35.0 74.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.923 -0.311 . . . . 1.1000000000000001 110.89 178.371 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.15 -59.76 4.04 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.636 0.731 . . . . 1.1200000000000001 109.832 176.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.5 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 94.3 m95 -54.05 -46.15 71.86 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.251 -1.34 . . . . 4.7699999999999996 110.437 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.888 ' HE3' ' HA ' ' A' ' 104' ' ' PHE . 1.4 mmm -59.15 -59.41 5.51 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.784 -0.644 . . . . 1.0900000000000001 112.067 -177.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -59.81 -36.05 75.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 120.685 -0.406 . . . . 1.05 110.392 -177.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.411 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 23.3 m -64.49 -49.22 72.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.601 -0.272 . . . . 1.1299999999999999 111.571 176.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.485 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 14.1 m-85 -58.0 -36.37 72.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.766 0.317 . . . . 3.3500000000000001 110.351 178.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.704 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.5 tt -64.85 -51.06 64.09 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.986 -0.746 . . . . 1.5900000000000001 108.986 171.81 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . 0.411 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 4.5 m-80 -48.7 -49.59 37.2 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.07 0.548 . . . . 0.46000000000000002 112.034 178.392 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -80.15 -50.59 10.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.258 -0.428 . . . . 0.58999999999999997 111.897 -174.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . 0.485 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 22.2 m-70 -90.69 -51.69 5.25 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.067 0.765 . . . . 2.3399999999999999 113.067 -170.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.704 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -82.71 -45.89 13.87 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.291 0.848 . . . . 1.8999999999999999 113.291 -167.078 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.682 ' HA ' HD12 ' A' ' 142' ' ' ILE . 22.8 tt0 -42.08 -53.64 8.24 Favored Pre-proline 0 CA--C 1.542 0.652 0 O-C-N 124.123 0.89 . . . . 0.75 113.167 -172.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.468 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 19.3 Cg_endo -61.09 -47.6 12.12 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.889 1.726 . . . . 0.87 111.998 178.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -55.37 -46.92 76.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.72 -0.673 . . . . 1.4299999999999999 110.065 177.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.682 HD12 ' HA ' ' A' ' 139' ' ' GLU . 48.4 mt -49.08 -52.06 11.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.793 -0.64 . . . . 1.1299999999999999 111.798 175.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.519 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.8 mm-40 -59.9 -30.67 69.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.984 -0.553 . . . . 0.57999999999999996 111.434 -179.061 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.7 mm-40 -65.63 -20.81 66.46 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.705 0.764 . . . . 0.78000000000000003 110.594 176.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -111.29 10.92 21.67 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.002 -0.999 . . . . 0.93000000000000005 109.917 -175.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 114.39 -46.84 1.11 Allowed Glycine 0 N--CA 1.44 -1.044 0 CA-C-N 114.861 -1.063 . . . . 0.56000000000000005 112.813 173.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . 0.562 ' HA2' HG21 ' A' ' 142' ' ' ILE . . . 131.56 178.46 15.49 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.717 -0.754 . . . . 0.48999999999999999 111.9 -177.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.531 ' NE1' HD11 ' A' ' 142' ' ' ILE . 7.0 m-90 -68.54 -41.9 79.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.62 0.248 . . . . 4.5199999999999996 110.778 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.418 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 23.3 t70 -59.84 -37.75 80.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.32 0.581 . . . . 1.96 109.862 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.634 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 62.2 m -60.93 -37.53 82.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.306 -0.861 . . . . 1.24 111.183 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.817 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 74.6 t80 -59.33 -40.53 86.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.059 0.457 . . . . 3.7200000000000002 109.954 177.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.682 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -74.6 -24.89 18.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.475 0.655 . . . . 1.8600000000000001 110.094 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 31.8 mm-40 -66.38 -22.9 66.25 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.396 0.617 . . . . 1.6699999999999999 110.082 172.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.634 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.7 mt -93.82 -58.53 2.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.648 -0.705 . . . . 1.96 110.552 177.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -122.07 30.16 6.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.047 -0.524 . . . . 4.3899999999999997 111.594 -173.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.74 ' HA2' ' HB3' ' A' ' 49' ' ' ALA . . . -62.95 155.72 41.87 Favored Glycine 0 CA--C 1.502 -0.764 0 CA-C-O 121.654 0.585 . . . . 1.1000000000000001 113.682 -177.437 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.494 ' OD1' ' HB3' ' A' ' 159' ' ' ALA . 21.6 t-20 -54.99 132.02 46.06 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 113.842 -1.179 . . . . 1.29 110.283 175.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.473 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 6.6 p-10 -80.02 17.97 0.9 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.454 0.538 . . . . 3.4399999999999999 112.454 -174.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . 0.494 ' HB3' ' OD1' ' A' ' 157' ' ' ASN . . . -49.37 -41.28 38.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.678 0.275 . . . . 2.6699999999999999 111.549 177.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -74.4 -36.94 63.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.55 -0.295 . . . . 2.8700000000000001 110.511 179.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -54.78 -59.31 4.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.058 -0.519 . . . . 3.2000000000000002 111.113 177.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.533 ' O ' ' HB3' ' A' ' 165' ' ' LYS . 4.5 pt-20 -66.35 -25.62 66.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.153 -0.476 . . . . 3.7200000000000002 111.834 179.071 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 7.6 t -70.42 -33.35 71.24 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.372 -0.603 . . . . 4.2000000000000002 109.372 176.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 40.3 mmt180 -72.15 -39.41 68.77 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.4 0.619 . . . . 6.3700000000000001 109.478 172.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.533 ' HB3' ' O ' ' A' ' 162' ' ' GLU . 24.4 ttpt -48.7 -49.68 36.8 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.236 -1.347 . . . . 5.0099999999999998 111.503 178.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -63.51 -40.01 98.28 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-N 115.818 -0.628 . . . . 5.0999999999999996 113.39 -174.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -85.59 -18.84 32.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.984 0.421 . . . . 5.9400000000000004 111.288 -178.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . 0.517 ' HG2' ' HB2' ' A' ' 172' ' ' HIS . 35.0 tt0 -73.79 -12.96 60.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.855 -0.611 . . . . 5.8799999999999999 110.085 176.445 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -56.06 -36.33 67.94 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.344 -0.844 . . . . 7.7999999999999998 111.291 -175.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -76.81 -50.87 12.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.353 -0.385 . . . . 7.29 111.995 -176.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -78.86 -30.85 45.31 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 111.963 0.356 . . . . 6.9699999999999998 111.963 -173.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . 0.517 ' HB2' ' HG2' ' A' ' 168' ' ' GLU . 94.6 m-70 -121.78 110.09 15.49 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.97 0.414 . . . . 9.8100000000000005 109.933 177.42 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 51.4 m-70 -90.14 116.56 28.24 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.861 -0.609 . . . . 11.99 110.724 -176.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -68.56 -40.94 80.43 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.067 -0.716 . . . . 11.949999999999999 109.067 174.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -95.6 110.89 22.92 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.973 -0.751 . . . . 14.949999999999999 108.973 169.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -93.65 9.13 38.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.956 -0.565 . . . . 15.880000000000001 110.909 -174.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -142.38 135.27 28.42 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.668 -0.697 . . . . 16.02 110.382 173.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 43.6 tp -141.4 -70.14 0.37 Allowed 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.208 -0.664 . . . . 18.210000000000001 109.208 177.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -137.61 158.79 43.62 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.615 -0.72 . . . . 19.219999999999999 109.732 178.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 50.1 m80 -100.51 -70.11 0.75 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.393 -0.367 . . . . 22.800000000000001 110.181 -178.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 10.5 m170 66.52 159.94 0.14 Allowed 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.736 -0.665 . . . . 22.510000000000002 111.774 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 58.53 -96.51 0.06 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.377 -0.829 . . . . 25.300000000000001 111.266 -176.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 35.9 m80 -151.24 142.71 23.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.804 0.335 . . . . 25.77 110.641 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -96.55 126.69 41.91 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.185 -0.672 . . . . 27.370000000000001 109.185 175.036 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 55.4 t60 . . . . . 0 C--O 1.246 0.881 0 CA-C-O 118.312 -0.852 . . . . 29.52 109.911 -177.817 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.206 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . 78.42 -84.43 1.18 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.001 -0.619 . . . . 2.9900000000000002 112.526 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.468 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . 30.4 m -122.51 -153.2 0.54 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.98 -0.378 . . . . 1.9399999999999999 109.98 -178.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.956 HG23 ' H ' ' B' 1005 ' ' GLY . 13.5 m 50.74 -88.36 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 124.849 1.259 . . . . 1.9399999999999999 112.985 172.126 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 0.956 ' H ' HG23 ' B' 1004 ' ' VAL . . . -34.94 -36.73 0.08 OUTLIER Glycine 0 CA--C 1.53 1.008 0 CA-C-N 119.078 0.854 . . . . 1.26 112.954 161.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B 1006 ' ' ARG . . . . . 0.515 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 6.9 mpt_? -89.23 -51.47 5.56 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.846 0.355 . . . . 3.4500000000000002 111.281 174.405 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B 1007 ' ' ALA . . . . . 0.536 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -69.07 -62.83 1.22 Allowed 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 113.244 0.831 . . . . 1.54 113.244 -167.054 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.642 HD13 ' CZ ' ' A' ' 106' ' ' PHE . 3.2 mm? -58.63 -53.23 60.72 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.149 -0.315 . . . . 1.8999999999999999 110.149 -176.307 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 0.908 ' HB3' ' HB2' ' A' ' 89' ' ' GLU . . . -38.0 -50.43 1.33 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.102 -0.954 . . . . 1.45 111.991 171.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.804 ' HB3' ' N11' ' B' 1100 ' ' 33B . . . -70.2 -47.88 59.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.084 -0.962 . . . . 1.51 111.706 -177.25 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.55 ' HE2' ' H8 ' ' B' 1100 ' ' 33B . 31.5 m-85 -66.52 -27.42 67.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.007 0.432 . . . . 2.0699999999999998 111.247 -179.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.67 -11.14 80.54 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.939 -0.573 . . . . 0.80000000000000004 112.905 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 36.0 t70 -76.51 -5.32 47.04 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.17 0.509 . . . . 1.8999999999999999 110.647 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 10.0 m -96.85 8.2 44.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.09 -0.505 . . . . 1.4399999999999999 111.053 -177.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.431 HD13 ' CE1' ' A' ' 57' ' ' PHE . 26.6 mt -93.62 67.52 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.495 0.664 . . . . 3.4300000000000002 109.835 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -129.46 -42.95 1.29 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.331 -0.85 . . . . 4.79 109.86 178.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -119.19 92.06 3.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.803 -0.635 . . . . 8.9800000000000004 110.213 176.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.584 0 CA-C-N 116.583 -0.281 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.804 ' N11' ' HB3' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.2 mtt . . . . . 0 N--CA 1.483 1.189 0 CA-C-O 120.922 0.391 . . . . 6.4500000000000002 110.807 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.425 ' HB2' ' OD1' ' A' ' 135' ' ' ASN . 3.0 p -79.2 0.95 26.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.894 0.378 . . . . 2.2599999999999998 111.713 -176.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 -102.0 -2.78 28.9 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 122.058 -0.401 . . . . 2.7599999999999998 110.812 175.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.1 t -86.67 -22.58 26.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.963 0.411 . . . . 1.54 110.731 -177.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.765 ' HA ' HD22 ' A' ' 8' ' ' LEU . 8.2 p30 -67.75 -22.66 65.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.106 0.479 . . . . 1.78 110.05 173.236 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.937 HH12 ' HA ' ' A' ' 128' ' ' ALA . 21.1 tpp180 -55.56 -49.6 72.26 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 115.263 -0.88 . . . . 1.8999999999999999 109.778 175.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.478 ' CD ' ' HG ' ' A' ' 43' ' ' SER . 32.3 mt-10 -56.3 -52.28 65.09 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.475 -1.239 . . . . 0.68000000000000005 111.176 -177.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.765 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.8 OUTLIER -44.54 -43.73 8.21 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.269 -0.878 . . . . 1.8 111.167 175.733 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 76.1 t -72.17 -61.41 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.337 0.589 . . . . 1.0700000000000001 110.482 176.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' ' 6' ' ' ARG . 68.2 t -52.91 -52.71 26.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.062 -0.972 . . . . 1.1299999999999999 113.036 -174.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -55.7 -34.52 65.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.066 0.46 . . . . 0.58999999999999997 110.549 -175.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.681 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 24.2 t80 -80.38 -43.01 21.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 116.102 -0.499 . . . . 2.02 111.132 -178.052 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.828 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 3.9 mp -59.02 -41.63 88.24 Favored 'General case' 0 CA--C 1.522 -0.113 0 C-N-CA 120.066 -0.654 . . . . 1.0600000000000001 109.526 176.408 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -55.58 -43.21 75.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.641 -0.709 . . . . 1.6000000000000001 110.604 176.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -71.45 -33.61 69.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.416 -0.811 . . . . 1.49 110.831 -177.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.68 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 9.9 mmpt? -76.54 -27.87 56.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.509 -0.314 . . . . 1.8400000000000001 111.593 -177.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.592 HD21 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -73.55 -29.51 62.49 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 120.103 -0.639 . . . . 1.98 109.871 174.512 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.3 t -65.57 -28.83 69.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.79 -0.641 . . . . 1.3799999999999999 111.526 -176.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 28.5 pt20 -79.14 -5.88 55.21 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.433 0.635 . . . . 1.51 110.86 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.519 ' HG3' HG12 ' A' ' 112' ' ' VAL . 18.6 mmmt -108.77 -25.17 10.95 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 122.148 0.975 . . . . 2.6499999999999999 108.946 -179.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.81 25.78 7.88 Favored Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 113.605 -1.634 . . . . 0.54000000000000004 111.227 179.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -120.33 166.74 13.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.315 -0.442 . . . . 1.1200000000000001 110.669 177.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.497 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 4.6 t -112.35 149.8 31.96 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.071 -0.513 . . . . 0.75 110.327 178.25 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.424 ' CE2' HG12 ' A' ' 10' ' ' VAL . 2.8 t90 -67.63 -50.65 56.99 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.031 0.443 . . . . 4.29 109.963 172.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.496 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 3.8 p -64.08 -31.65 72.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.559 -0.746 . . . . 1.8600000000000001 111.738 -171.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.497 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 95.0 mt-30 -56.4 -27.42 56.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.924 0.392 . . . . 1.52 111.371 178.046 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -120.61 11.33 11.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.26 -0.427 . . . . 1.53 111.382 -175.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.567 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 59.0 p -98.02 -178.05 3.95 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.784 0.661 . . . . 2.04 112.784 -170.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.531 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 11.1 t70 -170.66 -26.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 114.649 -1.16 . . . . 2.3100000000000001 109.441 -177.408 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.65 HG23 ' H ' ' A' ' 31' ' ' GLU . 6.6 m -47.43 -72.21 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-N 114.586 -1.188 . . . . 1.4099999999999999 112.866 -174.077 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.65 ' H ' HG23 ' A' ' 30' ' ' VAL . 7.9 pt-20 -102.48 1.17 34.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.483 0.659 . . . . 2.7400000000000002 109.386 175.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.531 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 15.5 tt0 -58.21 -42.21 85.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.017 -0.992 . . . . 1.45 111.435 -179.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -90.27 4.41 50.75 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.349 -0.842 . . . . 1.8700000000000001 113.024 -171.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -149.46 143.85 25.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.222 0.534 . . . . 3.8199999999999998 111.896 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.0 p -111.17 100.15 8.86 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.729 -0.668 . . . . 2.6699999999999999 110.146 176.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -135.46 -71.18 0.47 Allowed 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.659 -0.701 . . . . 3.3399999999999999 111.839 -167.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.709 ' HB2' ' HD2' ' A' ' 38' ' ' PRO . . . -66.08 160.8 61.22 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.848 -0.614 . . . . 2.4399999999999999 112.545 -174.155 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.709 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 31.5 Cg_endo -60.58 174.42 1.62 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 124.44 3.427 . . . . 1.8700000000000001 113.016 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -84.07 -1.73 55.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.562 -0.903 . . . . 4.6399999999999997 108.562 168.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.642 ' H ' ' HB2' ' A' ' 38' ' ' PRO . . . 146.89 81.47 0.04 OUTLIER Glycine 0 N--CA 1.437 -1.244 0 CA-C-N 114.018 -1.447 . . . . 2.3999999999999999 111.022 -179.334 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.893 HG22 ' H ' ' A' ' 42' ' ' GLU . 1.8 t -64.27 -73.91 0.11 Allowed 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 109.29 -0.633 . . . . 1.45 109.29 -176.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.893 ' H ' HG22 ' A' ' 41' ' ' THR . 13.7 pt-20 -93.28 -29.87 15.45 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 122.66 1.219 . . . . 2.02 108.418 164.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.664 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 6.7 p -60.42 -23.35 64.31 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 112.595 -2.093 . . . . 1.25 113.77 -170.241 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -55.91 -46.02 78.54 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.124 -0.63 . . . . 1.9099999999999999 109.9 179.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.483 ' HB2' HG21 ' A' ' 152' ' ' VAL . . . -76.57 -34.94 58.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.071 0.462 . . . . 1.1799999999999999 110.35 177.04 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.664 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 88.1 t -61.06 -61.08 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.514 -0.766 . . . . 2.0099999999999998 111.302 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.428 ' HB3' HD13 ' A' ' 8' ' ' LEU . 10.1 ptpt -59.91 -34.74 73.6 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.088 -0.708 . . . . 1.3799999999999999 109.088 -178.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.632 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 5.4 mm100 -64.79 -41.49 95.8 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.729 -0.669 . . . . 0.98999999999999999 110.393 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.72 ' HB3' ' HA2' ' A' ' 156' ' ' GLY . . . -67.71 -36.38 80.51 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.336 0.589 . . . . 1.1399999999999999 110.392 175.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.547 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.2 mp -72.41 -24.14 61.19 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.411 -0.813 . . . . 1.95 111.524 -178.255 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.632 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -81.31 -18.48 45.63 Favored 'General case' 0 CA--C 1.509 -0.613 0 C-N-CA 119.453 -0.899 . . . . 2.5099999999999998 109.027 178.0 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.501 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 4.3 mm-40 -80.46 -54.38 5.74 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.597 -1.183 . . . . 1.1000000000000001 109.983 175.302 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.83 -41.11 99.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.38 -0.827 . . . . 1.04 109.907 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.669 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -64.04 -43.61 97.08 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.299 -0.864 . . . . 0.69999999999999996 111.413 175.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 51' ' ' ARG . 19.1 t70 -52.85 -50.11 64.42 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.432 0.293 . . . . 1.04 110.964 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.718 ' O ' ' HG2' ' A' ' 60' ' ' ARG . 41.4 mt-10 -65.32 -28.22 69.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.138 -0.483 . . . . 2.29 110.955 179.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.509 ' HE2' ' HB3' ' A' ' 102' ' ' ALA . 0.3 OUTLIER -81.09 -19.86 42.75 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.388 -0.369 . . . . 2.9300000000000002 111.983 177.732 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.669 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 92.1 mt-10 -62.57 -57.07 12.44 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 122.516 -0.115 . . . . 1.3 111.15 -178.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.772 ' HA ' ' HB2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -62.99 -31.96 73.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.727 -0.215 . . . . 2.1899999999999999 111.255 179.191 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.718 ' HG2' ' O ' ' A' ' 56' ' ' GLU . 18.7 mmt180 -50.2 -52.03 39.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.231 -0.441 . . . . 3.1400000000000001 110.8 173.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.455 ' HB2' ' CZ ' ' A' ' 65' ' ' PHE . 28.9 m-85 -92.47 -3.83 54.57 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.206 -0.452 . . . . 5.5899999999999999 111.827 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.772 ' HB2' ' HA ' ' A' ' 59' ' ' LEU . 21.7 tpp180 -50.43 -50.81 51.04 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.577 0.584 . . . . 4.9299999999999997 112.577 -171.058 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -71.41 -16.29 62.39 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.191 0.519 . . . . 5.3499999999999996 111.084 -177.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.511 ' O ' HD12 ' A' ' 68' ' ' LEU . . . -90.2 -38.98 13.09 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.498 0.555 . . . . 1.7 112.498 -172.436 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.455 ' CZ ' ' HB2' ' A' ' 61' ' ' TYR . 44.8 m-85 -45.56 -46.46 14.16 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.247 0.832 . . . . 3.52 113.247 -170.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.9 t -66.27 -27.14 67.71 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.086 0.47 . . . . 2.5899999999999999 111.215 -174.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -88.56 -34.49 17.34 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.497 0.665 . . . . 2.7200000000000002 109.502 176.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.686 ' O ' HD11 ' A' ' 72' ' ' LEU . 5.5 mp -66.45 -31.37 72.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.139 -0.937 . . . . 2.25 112.595 -176.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.691 HG21 HG13 ' A' ' 74' ' ' ILE . 11.7 p -61.17 -24.23 66.16 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.109 -0.636 . . . . 1.26 110.661 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.1 t -77.65 -41.02 39.75 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.824 -0.625 . . . . 1.8 109.391 172.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.617 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 12.9 mt-30 -61.03 -49.48 77.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.369 -0.832 . . . . 1.8899999999999999 110.588 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.707 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.2 mp -75.53 -31.33 60.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.63 -0.713 . . . . 1.98 110.603 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 48.0 m80 65.92 59.69 0.7 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.64 0.733 . . . . 3.54 109.131 -172.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.691 HG13 HG21 ' A' ' 69' ' ' THR . 23.6 mm -59.29 112.79 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.4 -1.273 . . . . 1.1499999999999999 111.382 -178.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.747 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -153.07 -171.97 0.3 Allowed Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 107.781 -1.192 . . . . 1.1200000000000001 107.781 -170.029 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.747 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 21.7 Cg_exo -30.25 166.2 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 124.911 3.74 . . . . 0.53000000000000003 114.935 165.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.501 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -29.59 -30.23 0.01 OUTLIER Glycine 0 N--CA 1.472 1.058 0 N-CA-C 117.282 1.673 . . . . 0.40999999999999998 117.282 -172.085 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.457 ' N ' ' O ' ' A' ' 76' ' ' PRO . 32.2 p -67.87 6.12 0.75 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 118.019 0.909 . . . . 1.22 112.157 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.57 -12.92 61.87 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.962 0.411 . . . . 1.0700000000000001 109.982 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.501 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 5.0 p90 -78.26 -16.34 57.89 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.15 0.5 . . . . 4.3099999999999996 109.68 175.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.511 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 32.3 mt-30 -84.78 -24.51 28.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.775 0.798 . . . . 1.03 109.604 171.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.707 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 13.0 m -73.46 -52.1 14.84 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 114.566 -1.197 . . . . 0.47999999999999998 109.361 172.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.517 ' HA ' HG23 ' A' ' 86' ' ' VAL . 86.9 t80 -67.14 -17.02 64.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.183 -0.917 . . . . 1.4399999999999999 109.908 175.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.634 ' HA ' HG13 ' A' ' 87' ' ' VAL . 43.0 tt0 -58.54 -48.86 79.47 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.033 -0.531 . . . . 0.80000000000000004 110.195 174.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -47.14 -35.45 7.24 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.176 -0.92 . . . . 1.99 110.917 174.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.729 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.7 t -82.14 -49.91 16.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 114.534 -1.212 . . . . 1.8999999999999999 110.503 -175.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.634 HG13 ' HA ' ' A' ' 84' ' ' GLU . 8.4 p -62.8 -21.35 27.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 O-C-N 121.494 -0.754 . . . . 1.4299999999999999 109.991 179.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.464 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 3.0 m-80 -78.44 -37.34 43.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.373 -1.285 . . . . 0.91000000000000003 112.475 177.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 1.078 ' HB2' ' HB1' ' B' 1009 ' ' ALA . 1.3 pp20? -73.38 -29.27 62.52 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 108.904 -0.776 . . . . 2.8700000000000001 108.904 175.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.747 ' HB3' ' NH1' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -72.72 -35.82 67.65 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-N 114.549 -1.205 . . . . 1.9199999999999999 111.401 -168.087 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.464 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -103.87 12.91 33.85 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.136 0.493 . . . . 2.9700000000000002 110.918 -173.168 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.892 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -51.91 -43.12 63.26 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.404 -0.816 . . . . 5.6699999999999999 112.09 -178.318 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.853 ' HB3' HD22 ' A' ' 96' ' ' ASN . 14.7 t70 -74.0 -23.12 59.39 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 122.066 0.936 . . . . 3.1200000000000001 110.371 177.113 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.819 ' O ' HG21 ' A' ' 95' ' ' VAL . . . 131.03 -38.7 1.89 Allowed Glycine 0 N--CA 1.436 -1.307 0 CA-C-N 114.037 -1.438 . . . . 2.3100000000000001 110.245 177.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.819 HG21 ' O ' ' A' ' 94' ' ' GLY . 2.7 t 172.88 135.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.347 0.488 0 C-N-CA 126.96 2.104 . . . . 1.6799999999999999 108.388 160.075 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.853 HD22 ' HB3' ' A' ' 93' ' ' ASP . 2.9 m120 -111.35 147.14 35.79 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.431 -0.581 . . . . 2.1200000000000001 109.431 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.556 ' HA ' ' CE3' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -54.51 -46.49 73.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.188 0.518 . . . . 4.1200000000000001 110.581 177.437 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 1.013 ' HA3' HG12 ' B' 1015 ' ' ILE . . . -79.32 -19.57 71.49 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.925 -0.655 . . . . 0.80000000000000004 112.872 -178.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.758 ' HG2' ' H ' ' A' ' 96' ' ' ASN . 0.1 OUTLIER -72.45 -28.74 63.13 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.73 -0.47 . . . . 4.9100000000000001 109.73 -179.354 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 77.5 mt -65.27 -38.52 82.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.76 -0.459 . . . . 1.1100000000000001 109.76 177.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.467 ' HA ' ' CD1' ' A' ' 104' ' ' PHE . 2.0 m -69.66 -34.69 62.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 116.134 -0.484 . . . . 2.0299999999999998 109.93 175.218 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.509 ' HB3' ' HE2' ' A' ' 57' ' ' PHE . . . -63.23 -49.34 74.52 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.558 0.694 . . . . 1.0600000000000001 110.078 175.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -55.13 -49.11 72.59 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.313 -1.312 . . . . 1.8400000000000001 111.715 -179.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.582 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 0.2 OUTLIER -77.27 -26.59 52.57 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.489 -0.484 . . . . 4.21 110.832 -176.336 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.681 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 29.2 t -73.55 -49.42 26.53 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.109 0.48 . . . . 1.55 110.197 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.536 ' HZ ' HD12 ' A' ' 72' ' ' LEU . 29.2 t80 -71.2 -24.89 62.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.893 -0.594 . . . . 3.6400000000000001 109.802 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.19 -43.25 81.1 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.804 -0.712 . . . . 0.32000000000000001 111.334 172.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.828 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.61 -32.41 84.08 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.77 -0.729 . . . . 0.23999999999999999 111.319 174.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.58 -30.02 61.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.827 0.346 . . . . 1.05 110.639 175.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.536 ' HB3' HD11 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.8 -41.18 97.96 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 107.988 -1.116 . . . . 1.78 107.988 -179.634 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.65 ' SG ' HG22 ' A' ' 123' ' ' VAL . 25.0 t -52.58 -54.55 31.47 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.468 -1.696 . . . . 0.90000000000000002 110.904 173.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.519 HG12 ' HG3' ' A' ' 20' ' ' LYS . 68.9 t -64.37 -41.25 91.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 1.2 111.588 -177.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.48 ' HB3' HG22 ' A' ' 74' ' ' ILE . 1.4 mm-40 -60.62 -25.03 65.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.035 0.445 . . . . 2.5099999999999998 110.746 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.435 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 50.6 m -77.14 -40.59 45.05 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 108.896 -0.779 . . . . 0.28000000000000003 108.896 174.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 111' ' ' CYS . 98.2 t -64.47 -35.42 74.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.095 -0.957 . . . . 1.8300000000000001 109.461 -179.613 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -50.17 -50.89 47.67 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 113.582 -1.645 . . . . 0.59999999999999998 111.129 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.439 ' CG ' ' HE2' ' A' ' 119' ' ' MET . 12.8 mmtp -87.2 14.1 8.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.703 -0.68 . . . . 2.1600000000000001 110.621 -179.188 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 66.1 38.34 4.8 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.443 0.639 . . . . 1.8799999999999999 110.308 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.439 ' HE2' ' CG ' ' A' ' 117' ' ' LYS . 24.7 mtm -117.71 50.16 1.16 Allowed 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.551 -0.907 . . . . 1.0800000000000001 108.551 -178.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.422 ' HA ' HG21 ' A' ' 123' ' ' VAL . 3.6 mt-30 -65.63 -7.1 13.35 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.725 -1.125 . . . . 1.1499999999999999 112.285 -176.116 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.551 HG22 HD22 ' A' ' 122' ' ' LEU . 30.0 m -68.04 -20.54 25.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.616 0.246 . . . . 1.1899999999999999 111.349 173.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.745 HD11 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -76.39 -27.18 56.25 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 110.216 -0.29 . . . . 1.0600000000000001 110.216 177.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.65 HG22 ' SG ' ' A' ' 111' ' ' CYS . 56.3 t -44.69 -53.15 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 O-C-N 123.986 0.804 . . . . 1.0 112.162 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.567 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 1.5 p -69.93 -39.42 76.14 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-O 120.86 0.362 . . . . 1.6599999999999999 111.587 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.745 ' HD2' HD11 ' A' ' 122' ' ' LEU . 92.2 mtt180 -62.15 -55.5 28.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.571 -0.74 . . . . 3.2999999999999998 110.183 -177.252 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.611 ' HA ' ' CE2' ' A' ' 129' ' ' TRP . 77.9 mt -51.93 -51.14 30.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.512 -0.767 . . . . 1.0600000000000001 111.177 -179.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.645 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.81 -25.57 63.29 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.804 0.298 . . . . 1.1000000000000001 111.804 -178.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.937 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -67.35 -63.88 0.97 Allowed 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.131 0.491 . . . . 1.1200000000000001 110.089 -178.34 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . 0.611 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 24.1 p-90 -78.1 -16.72 57.74 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 115.304 -0.862 . . . . 4.7699999999999996 112.059 -174.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.596 ' SD ' HG22 ' A' ' 126' ' ' ILE . 81.7 mtp -59.39 -54.35 47.77 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.144 -0.622 . . . . 1.0900000000000001 109.822 169.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.47 -38.29 77.67 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.763 -0.653 . . . . 1.05 110.689 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.584 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 56.7 m -60.92 -43.34 98.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 121.062 -0.255 . . . . 1.1299999999999999 111.378 175.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.467 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 82.7 t80 -59.71 -43.09 94.28 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.963 -0.384 . . . . 3.3500000000000001 109.963 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.668 HD13 ' HB2' ' A' ' 5' ' ' ASN . 5.4 tt -60.62 -47.62 85.42 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.734 -0.839 . . . . 1.5900000000000001 108.734 174.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . 0.425 ' OD1' ' HB2' ' A' ' 2' ' ' SER . 2.8 m-80 -48.37 -58.59 4.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.663 -0.699 . . . . 0.46000000000000002 112.394 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -81.39 -45.56 15.92 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.197 0.443 . . . . 0.58999999999999997 112.197 -173.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . 0.467 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 1.6 m-70 -90.64 -50.14 6.09 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.744 0.646 . . . . 2.3399999999999999 112.744 -170.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.611 HD21 ' NH2' ' A' ' 99' ' ' ARG . 59.9 mt -89.33 -39.03 13.72 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 113.44 0.904 . . . . 1.8999999999999999 113.44 -165.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.637 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 32.1 tt0 -50.81 -52.45 57.01 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-O 119.134 -0.46 . . . . 0.75 112.098 -172.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.622 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.1 Cg_exo -53.85 -51.71 10.11 Favored 'Trans proline' 0 C--N 1.358 1.049 0 C-N-CA 121.772 1.648 . . . . 0.87 111.505 176.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . 0.467 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 8.4 t-105 -55.14 -51.9 64.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.186 -0.915 . . . . 1.4299999999999999 110.678 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.629 HD13 ' HA ' ' A' ' 139' ' ' GLU . 59.7 mt -46.85 -53.06 3.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.884 -0.598 . . . . 1.1299999999999999 111.654 172.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.637 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 76.3 mm-40 -62.18 -29.87 70.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.085 -0.507 . . . . 0.57999999999999996 111.675 -178.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.622 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 11.6 mm-40 -63.95 -20.57 65.97 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.611 0.72 . . . . 0.78000000000000003 110.437 175.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.657 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -104.1 0.94 30.28 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.072 -0.967 . . . . 0.93000000000000005 109.019 -175.487 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 124.8 -46.24 1.1 Allowed Glycine 0 N--CA 1.441 -1.028 0 CA-C-N 114.85 -1.068 . . . . 0.56000000000000005 112.299 178.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . 0.421 ' HA2' HG23 ' A' ' 142' ' ' ILE . . . 135.03 178.21 15.51 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.238 -0.745 . . . . 0.48999999999999999 111.238 -177.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.678 ' HB2' ' OE1' ' A' ' 42' ' ' GLU . 5.2 m-90 -63.5 -37.66 88.17 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 117.056 0.428 . . . . 4.5199999999999996 110.412 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.424 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 20.7 m-20 -52.85 -43.9 66.39 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.211 0.529 . . . . 1.96 110.203 176.243 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.569 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 89.2 m -60.24 -37.82 81.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.211 -0.904 . . . . 1.24 111.95 -175.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.427 ' CE2' HD11 ' A' ' 50' ' ' LEU . 84.7 t80 -62.97 -38.46 91.19 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.402 -0.519 . . . . 3.7200000000000002 109.989 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.584 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.5 m -74.67 -24.57 18.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.222 0.534 . . . . 1.8600000000000001 109.774 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 36.2 mm-40 -64.35 -25.49 68.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.201 0.524 . . . . 1.6699999999999999 110.081 173.042 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.0 mt -96.03 -57.42 2.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.697 -0.683 . . . . 1.96 110.476 178.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -120.36 28.82 7.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.561 -0.745 . . . . 4.3899999999999997 111.279 -170.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.72 ' HA2' ' HB3' ' A' ' 49' ' ' ALA . . . -60.94 167.69 10.84 Favored Glycine 0 CA--C 1.501 -0.817 0 CA-C-N 115.576 -0.738 . . . . 1.1000000000000001 113.258 179.257 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.524 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 28.8 t-20 -56.65 114.94 2.26 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 113.994 -1.103 . . . . 1.29 111.49 -178.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.643 ' HA ' ' HB1' ' A' ' 161' ' ' ALA . 9.5 m120 -72.11 -27.53 62.69 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.146 0.424 . . . . 3.4399999999999999 112.146 -173.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -57.53 -38.52 74.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.206 0.527 . . . . 2.6699999999999999 110.224 175.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.416 ' HB1' ' NH2' ' A' ' 164' ' ' ARG . . . -88.34 -36.75 16.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.818 -0.628 . . . . 2.8700000000000001 110.706 176.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 0.643 ' HB1' ' HA ' ' A' ' 158' ' ' ASN . . . -58.66 -55.97 28.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.209 -0.451 . . . . 3.2000000000000002 111.537 -178.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -66.6 -25.39 66.59 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.465 -0.334 . . . . 3.7200000000000002 110.958 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 23.3 t -69.74 -44.88 69.34 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.77 -0.456 . . . . 4.2000000000000002 109.77 176.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . 0.416 ' NH2' ' HB1' ' A' ' 160' ' ' ALA . 0.2 OUTLIER -68.48 -32.05 71.77 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.982 0.42 . . . . 6.3700000000000001 110.403 176.596 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -59.58 -38.57 81.53 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.189 -0.914 . . . . 5.0099999999999998 110.303 178.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -59.97 -47.61 90.14 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 115.657 -0.701 . . . . 5.0999999999999996 112.678 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -80.25 -21.27 42.95 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.913 0.387 . . . . 5.9400000000000004 110.793 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . 0.407 ' O ' ' HD2' ' A' ' 172' ' ' HIS . 29.2 tt0 -70.17 -17.13 63.16 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.436 -0.579 . . . . 5.8799999999999999 109.436 175.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.404 ' O ' ' HD3' ' A' ' 169' ' ' ARG . 0.3 OUTLIER -67.05 -34.58 77.99 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.805 -0.813 . . . . 7.7999999999999998 108.805 178.89 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.405 HD11 ' HA ' ' A' ' 170' ' ' LEU . 4.0 mm? -82.54 -14.19 55.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.179 -0.919 . . . . 7.29 110.151 178.145 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -81.22 -44.09 18.3 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.476 -0.784 . . . . 6.9699999999999998 109.627 176.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . 0.407 ' HD2' ' O ' ' A' ' 168' ' ' GLU . 57.3 m-70 -60.89 -35.29 76.27 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.007 -0.542 . . . . 9.8100000000000005 110.589 177.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -90.17 91.08 8.38 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.567 -0.531 . . . . 11.99 109.567 174.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 72.3 m-70 -80.34 174.66 11.38 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.054 -0.521 . . . . 11.949999999999999 110.455 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -59.66 151.31 25.18 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.084 -0.507 . . . . 14.949999999999999 110.094 175.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -63.35 140.94 58.92 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.43 -0.35 . . . . 15.880000000000001 110.208 -178.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 71.6 m80 -68.27 -43.32 78.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.334 -0.394 . . . . 16.02 110.19 179.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 92.6 mt 59.9 -175.21 0.1 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.82 -0.627 . . . . 18.210000000000001 111.861 177.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 59.52 82.66 0.15 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.533 -0.758 . . . . 19.219999999999999 111.44 177.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 64.3 m80 62.66 27.42 16.14 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.724 -0.671 . . . . 22.800000000000001 111.658 176.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -89.71 129.97 36.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.451 -0.341 . . . . 22.510000000000002 110.356 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -98.94 170.66 8.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.24 -0.437 . . . . 25.300000000000001 110.853 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 42.2 m80 -68.06 125.36 26.09 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.048 -0.524 . . . . 25.77 110.79 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -60.29 -30.41 69.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.951 -0.568 . . . . 27.370000000000001 110.476 177.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 46.2 t-80 . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.602 -0.713 . . . . 29.52 109.615 178.52 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.17 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -71.39 131.0 19.19 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.856 -0.687 . . . . 2.9900000000000002 112.384 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.583 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . 62.7 m 61.2 -120.65 0.8 Allowed 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 122.357 0.263 . . . . 1.9399999999999999 110.905 -179.118 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 1.001 HG21 ' H ' ' B' 1005 ' ' GLY . 30.4 m 40.22 -88.89 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 125.151 1.38 . . . . 1.9399999999999999 113.902 174.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 1.001 ' H ' HG21 ' B' 1004 ' ' VAL . . . -38.73 -33.7 0.23 Allowed Glycine 0 CA--C 1.529 0.918 0 CA-C-N 118.505 0.593 . . . . 1.26 113.416 169.338 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B 1006 ' ' ARG . . . . . 0.527 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 6.4 mpt_? -83.3 -56.86 3.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.003 0.43 . . . . 3.4500000000000002 111.133 174.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B 1007 ' ' ALA . . . . . 0.632 ' HB1' ' O2 ' ' B' 1100 ' ' 33B . . . -67.83 -54.98 14.74 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.895 0.702 . . . . 1.54 112.895 -169.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.729 ' HG ' HG12 ' A' ' 86' ' ' VAL . 3.0 mm? -58.44 -53.64 56.01 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.227 0.329 . . . . 1.8999999999999999 110.965 -175.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 1.078 ' HB1' ' HB2' ' A' ' 89' ' ' GLU . . . -47.65 -45.74 28.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.701 0.762 . . . . 1.45 110.848 176.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.796 ' HB2' ' N11' ' B' 1100 ' ' 33B . . . -67.12 -54.45 21.23 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.303 -1.317 . . . . 1.51 111.406 -177.086 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.602 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 58.7 m-85 -66.71 -17.1 64.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.516 . . . . 2.0699999999999998 110.528 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -83.94 -3.99 88.85 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.863 -0.608 . . . . 0.80000000000000004 113.467 -176.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -93.56 3.9 54.8 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.645 0.736 . . . . 1.8999999999999999 109.796 176.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 34.4 m -97.14 28.25 3.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.668 -0.696 . . . . 1.4399999999999999 111.687 -175.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 1.013 HG12 ' HA3' ' A' ' 98' ' ' GLY . 0.5 OUTLIER -76.22 72.32 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.988 0.423 . . . . 3.4300000000000002 110.797 176.399 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 15.8 m120 -128.32 131.8 48.64 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.836 -0.62 . . . . 4.79 110.03 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -116.41 86.01 2.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.304 -0.407 . . . . 8.9800000000000004 110.49 -176.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.634 0 CA-C-N 116.523 -0.308 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.796 ' N11' ' HB2' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 110.081 -0.34 . . . . 6.4500000000000002 110.081 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.9 p 49.31 27.85 2.06 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.766 0.826 . . . . 2.2599999999999998 112.88 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.422 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 42.1 tp60 -90.81 0.81 57.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.682 0.753 . . . . 2.7599999999999998 109.546 179.098 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.437 ' CB ' ' HG2' ' A' ' 42' ' ' GLU . 0.9 OUTLIER -72.78 -3.97 28.65 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.097 -0.956 . . . . 1.54 110.852 -178.427 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.541 ' HB2' ' HG ' ' A' ' 134' ' ' LEU . 3.3 p30 -62.97 -26.66 68.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.986 -0.552 . . . . 1.78 111.218 177.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.805 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.9 tpp180 -51.52 -49.87 61.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.05 -0.523 . . . . 1.8999999999999999 110.506 173.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.791 ' HB3' ' HE3' ' A' ' 47' ' ' LYS . 53.1 mt-10 -50.49 -52.74 35.56 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.964 -1.017 . . . . 0.68000000000000005 112.066 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.632 HD11 HG21 ' A' ' 46' ' ' VAL . 1.2 mp -50.71 -31.47 16.59 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.913 0.885 . . . . 1.8 112.094 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.448 HG22 ' N ' ' A' ' 131' ' ' ALA . 96.3 t -80.35 -60.35 2.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-O 121.48 0.657 . . . . 1.0700000000000001 110.023 174.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.578 HG22 ' O ' ' A' ' 6' ' ' ARG . 46.4 t -53.37 -54.2 19.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 114.79 -1.095 . . . . 1.1299999999999999 112.755 -174.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -57.25 -36.53 71.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.128 0.489 . . . . 0.58999999999999997 110.316 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.688 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -66.31 -53.54 35.33 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.633 -0.712 . . . . 2.02 109.985 179.246 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.999 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.7 mp -60.68 -38.5 85.15 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 120.699 0.285 . . . . 1.0600000000000001 110.827 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.505 ' HA ' ' CB ' ' A' ' 24' ' ' TRP . 27.0 t -60.67 -37.05 80.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.17 0.51 . . . . 1.6000000000000001 110.677 177.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -77.07 -23.81 51.92 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.975 -0.557 . . . . 1.49 110.252 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.769 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 8.8 mmpt? -81.67 -39.94 23.6 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.281 -0.418 . . . . 1.8400000000000001 111.648 -177.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.591 HD23 ' HA ' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -61.99 -27.84 69.15 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 119.926 -0.709 . . . . 1.98 110.183 176.294 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.7 t -75.04 -13.9 60.54 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.526 -0.761 . . . . 1.3799999999999999 111.337 -177.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.769 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 20.7 pt20 -81.01 -9.39 59.85 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.388 0.613 . . . . 1.51 111.883 -177.28 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.753 ' NZ ' HG12 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -120.02 -20.3 7.52 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 122.048 0.928 . . . . 2.6499999999999999 109.646 178.828 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.65 29.98 5.4 Favored Glycine 0 C--N 1.305 -1.18 0 CA-C-N 113.869 -1.514 . . . . 0.54000000000000004 112.799 175.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -109.82 169.69 8.55 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.715 0.293 . . . . 1.1200000000000001 110.909 168.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.5 t -105.27 150.19 25.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.153 0.501 . . . . 0.75 110.843 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.591 ' HA ' HD23 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -81.11 -43.79 18.91 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.346 -0.843 . . . . 4.29 110.032 172.88 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.435 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 7.0 p -71.21 -23.51 62.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.971 -0.559 . . . . 1.8600000000000001 111.564 -172.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -65.15 -27.26 68.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.902 0.382 . . . . 1.52 110.966 175.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -122.28 16.56 10.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.05 -0.523 . . . . 1.53 112.21 -174.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.435 ' OG ' ' HA ' ' A' ' 25' ' ' SER . 90.2 p -100.61 -179.23 4.03 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.88 0.696 . . . . 2.04 112.88 -172.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.546 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.9 t70 -168.59 -24.19 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.324 -1.307 . . . . 2.3100000000000001 109.806 178.716 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.665 HG23 ' H ' ' A' ' 31' ' ' GLU . 9.2 m -47.48 -70.95 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 114.912 -1.04 . . . . 1.4099999999999999 113.08 -171.646 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.665 ' H ' HG23 ' A' ' 30' ' ' VAL . 9.3 pt-20 -100.82 2.43 41.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.721 0.772 . . . . 2.7400000000000002 109.054 175.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.546 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 29.5 tt0 -70.59 -59.02 3.07 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 114.624 -1.171 . . . . 1.45 111.127 -177.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -94.18 -41.62 9.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.981 -0.554 . . . . 1.8700000000000001 111.038 -173.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.516 ' HG2' ' O ' ' A' ' 30' ' ' VAL . 9.4 ptp180 -96.75 152.13 18.97 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.472 -0.566 . . . . 3.8199999999999998 109.472 177.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.5 p -128.68 104.23 7.53 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-O 121.665 0.745 . . . . 2.6699999999999999 111.028 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -104.98 -75.72 0.62 Allowed 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.913 -1.04 . . . . 3.3399999999999999 108.927 -178.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.422 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . . . -100.71 153.9 37.47 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.435 -0.802 . . . . 2.4399999999999999 109.672 173.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.759 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 54.0 Cg_exo -52.93 162.39 2.65 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 C-N-CA 122.848 2.365 . . . . 1.8700000000000001 112.581 173.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -76.92 1.31 18.02 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.315 -0.402 . . . . 4.6399999999999997 111.048 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.728 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 179.18 66.93 0.07 OUTLIER Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 121.028 -0.606 . . . . 2.3999999999999999 112.025 177.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.783 HG22 ' H ' ' A' ' 42' ' ' GLU . 1.5 t -90.03 -76.02 0.44 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 120.351 -0.54 . . . . 1.45 111.482 -177.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.783 ' H ' HG22 ' A' ' 41' ' ' THR . 11.9 pt-20 -94.56 -30.58 14.3 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-O 122.152 0.977 . . . . 2.02 110.376 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.804 ' HA ' HG13 ' A' ' 46' ' ' VAL . 58.5 m -75.66 -17.85 59.84 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.725 -1.58 . . . . 1.25 114.372 -166.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.588 ' HA ' ' CD ' ' A' ' 47' ' ' LYS . 39.4 tt0 -45.68 -47.02 15.09 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 118.237 0.471 . . . . 1.9099999999999999 111.113 -177.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.64 -46.03 64.06 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.721 0.267 . . . . 1.1799999999999999 111.721 175.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.804 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.9 m -67.1 -35.47 74.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 120.946 0.403 . . . . 2.0099999999999998 111.309 -175.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.791 ' HE3' ' HB3' ' A' ' 7' ' ' GLU . 6.8 ptmt -77.66 -32.29 53.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.963 -0.754 . . . . 1.3799999999999999 108.963 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.722 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -66.08 -30.47 70.99 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.719 -0.673 . . . . 0.98999999999999999 110.131 173.512 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.58 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -76.95 -42.66 38.3 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.233 0.54 . . . . 1.1399999999999999 111.077 176.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.55 HD21 ' HD2' ' A' ' 104' ' ' PHE . 1.3 tp -66.29 -25.1 66.7 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.621 -0.718 . . . . 1.95 112.486 -173.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.722 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.9 ptp180 -81.33 -28.42 34.55 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 109.069 -0.715 . . . . 2.5099999999999998 109.069 -175.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 10.8 mm-40 -74.2 -49.17 24.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.546 -1.206 . . . . 1.1000000000000001 109.38 176.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.65 -39.35 88.01 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.483 -0.78 . . . . 1.04 110.092 174.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.655 ' HA3' ' HZ ' ' A' ' 12' ' ' PHE . . . -63.91 -43.88 96.87 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.59 -0.732 . . . . 0.69999999999999996 112.047 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.597 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 32.6 t70 -58.14 -43.74 87.47 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.691 0.281 . . . . 1.04 110.256 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -58.19 -28.3 64.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.687 -0.688 . . . . 2.29 111.381 177.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -81.69 -44.54 16.98 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.919 -0.582 . . . . 2.9300000000000002 110.83 176.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.654 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 37.4 mt-10 -61.96 -63.2 1.33 Allowed 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.833 -0.621 . . . . 1.3 112.007 -172.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.691 HD13 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -48.9 -34.25 12.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.999 0.74 . . . . 2.1899999999999999 112.999 -173.738 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.691 ' H ' HD13 ' A' ' 59' ' ' LEU . 71.5 mtt-85 -62.88 -61.6 2.29 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.109 0.481 . . . . 3.1400000000000001 111.45 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -92.05 -3.61 55.55 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.827 -0.624 . . . . 5.5899999999999999 112.073 -173.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -49.93 -29.58 8.62 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 113.047 0.758 . . . . 4.9299999999999997 113.047 -175.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.9 mtp180 -54.32 -34.08 60.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.799 0.333 . . . . 5.3499999999999996 111.741 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.622 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -88.72 -26.6 21.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.491 -0.322 . . . . 1.7 111.418 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.597 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 39.0 t80 -46.83 -45.99 20.52 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.557 0.577 . . . . 3.52 112.557 -173.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.4 p -69.0 -24.92 64.28 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.848 0.356 . . . . 2.5899999999999999 111.629 -175.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -90.57 -29.77 17.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.482 -0.326 . . . . 2.7200000000000002 111.182 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.644 ' O ' HD13 ' A' ' 72' ' ' LEU . 18.8 mt -61.55 -22.77 65.46 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 112.589 0.589 . . . . 2.25 112.589 -173.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.618 HG23 HG13 ' A' ' 74' ' ' ILE . 15.8 p -58.68 -23.31 59.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 1.26 110.956 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 7.6 t -77.66 -38.99 46.49 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.903 -0.59 . . . . 1.8 109.64 176.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.51 ' NE2' HD22 ' A' ' 68' ' ' LEU . 12.4 mt-30 -65.15 -54.45 29.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.691 -0.686 . . . . 1.8899999999999999 109.837 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.644 HD13 ' O ' ' A' ' 68' ' ' LEU . 1.2 mp -66.36 -30.48 70.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.452 -0.794 . . . . 1.98 110.129 179.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 63.71 59.83 1.13 Allowed 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 122.167 0.984 . . . . 3.54 108.474 -175.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.636 HG21 ' HE1' ' A' ' 119' ' ' MET . 17.2 mm -57.82 122.96 8.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 113.789 -1.55 . . . . 1.1499999999999999 111.01 -178.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.753 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -157.34 -172.82 0.34 Allowed Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 108.021 -1.104 . . . . 1.1200000000000001 108.021 -168.825 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.753 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 34.9 Cg_exo -29.63 165.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 125.119 3.879 . . . . 0.53000000000000003 115.266 165.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.416 ' N ' HD13 ' A' ' 122' ' ' LEU . . . -29.56 -29.9 0.01 OUTLIER Glycine 0 N--CA 1.473 1.151 0 N-CA-C 117.33 1.692 . . . . 0.40999999999999998 117.33 -174.034 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 76' ' ' PRO . 39.4 p -71.66 11.08 0.54 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 117.79 0.795 . . . . 1.22 111.938 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.01 -13.17 61.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.246 0.546 . . . . 1.0700000000000001 109.736 172.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -78.79 -14.57 59.19 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.173 -0.677 . . . . 4.3099999999999996 109.173 175.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.41 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 53.5 mt-30 -84.52 -20.87 30.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.828 0.823 . . . . 1.03 109.917 172.612 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.579 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 6.5 m -80.02 -48.64 12.99 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 114.575 -1.193 . . . . 0.47999999999999998 108.828 169.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -62.75 -17.43 60.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.887 -1.051 . . . . 1.4399999999999999 109.915 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.629 ' HA ' HG12 ' A' ' 87' ' ' VAL . 34.7 tt0 -60.49 -50.44 73.53 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.458 -0.792 . . . . 0.80000000000000004 110.579 177.437 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -47.47 -35.14 8.22 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.01 -0.995 . . . . 1.99 110.702 176.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.632 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.6 t -81.83 -51.38 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.978 0 CA-C-N 114.485 -1.234 . . . . 1.8999999999999999 110.7 -177.111 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.629 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.8 p -61.58 -23.9 32.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-O 121.554 0.692 . . . . 1.4299999999999999 109.731 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.432 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.8 m-80 -71.99 -40.74 68.34 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.402 -1.272 . . . . 0.91000000000000003 111.977 176.433 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 1.05 ' HB2' ' HB1' ' B' 1009 ' ' ALA . 1.3 pp20? -73.23 -29.43 62.78 Favored 'General case' 0 CA--C 1.495 -1.149 0 CA-C-O 121.699 0.761 . . . . 2.8700000000000001 109.127 177.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.497 HD11 ' OE2' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -71.05 -32.52 69.27 Favored 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.556 -1.202 . . . . 1.9199999999999999 111.619 -168.158 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.404 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 2.3 p90 -107.47 11.69 28.59 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.108 0.48 . . . . 2.9700000000000002 110.859 -172.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.9 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -54.42 -34.53 61.53 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.685 -0.689 . . . . 5.6699999999999999 112.553 -177.789 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.935 ' HB3' HD22 ' A' ' 96' ' ' ASN . 15.4 t70 -84.48 -18.76 34.8 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 122.101 0.953 . . . . 3.1200000000000001 110.239 176.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.832 ' O ' HG23 ' A' ' 95' ' ' VAL . . . 130.95 -40.0 1.71 Allowed Glycine 0 N--CA 1.44 -1.037 0 CA-C-N 114.234 -1.348 . . . . 2.3100000000000001 110.918 173.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.832 HG23 ' O ' ' A' ' 94' ' ' GLY . 2.9 t 173.36 110.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.349 0.566 0 C-N-CA 127.022 2.129 . . . . 1.6799999999999999 108.15 160.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.935 HD22 ' HB3' ' A' ' 93' ' ' ASP . 1.1 m120 -83.91 152.83 24.3 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.753 -0.462 . . . . 2.1200000000000001 109.753 -177.023 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.537 ' HH2' ' HB2' ' A' ' 155' ' ' TYR . 84.9 t90 -59.04 -52.84 64.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.272 0.558 . . . . 4.1200000000000001 110.111 178.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 1.057 ' HA3' HG12 ' B' 1015 ' ' ILE . . . -77.41 -16.34 80.5 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.646 -0.706 . . . . 0.80000000000000004 112.698 -177.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.804 ' HB3' ' HB2' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -72.51 -29.26 63.45 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.535 -0.542 . . . . 4.9100000000000001 109.535 -179.635 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 33.0 mt -63.3 -45.11 99.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 109.394 -0.595 . . . . 1.1100000000000001 109.394 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.8 m -62.6 -39.33 84.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.827 -0.624 . . . . 2.0299999999999998 109.648 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.24 -44.86 94.02 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 121.087 0.47 . . . . 1.0600000000000001 111.04 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -58.66 -42.06 87.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.289 -0.869 . . . . 1.8400000000000001 110.956 -179.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.653 ' HZ ' ' HB2' ' A' ' 134' ' ' LEU . 28.9 m-85 -80.63 -30.18 36.71 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.671 0.272 . . . . 4.21 111.145 179.229 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.58 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 48.0 t -63.65 -56.23 17.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.153 -0.476 . . . . 1.55 110.222 176.003 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.485 ' HZ ' HD11 ' A' ' 72' ' ' LEU . 32.7 t80 -74.31 -26.34 60.11 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.928 -0.578 . . . . 3.6400000000000001 110.364 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.99 -45.59 86.68 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.336 -0.935 . . . . 0.32000000000000001 111.016 173.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.999 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.5 -29.42 74.78 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 111.11 -0.796 . . . . 0.23999999999999999 111.11 174.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.597 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -71.51 -34.54 70.19 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.983 -0.377 . . . . 1.05 109.983 176.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.469 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.3 OUTLIER -67.55 -34.88 77.97 Favored 'General case' 0 CA--C 1.506 -0.741 0 CA-C-O 121.892 0.853 . . . . 1.78 109.781 -179.267 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.755 ' HG ' HG11 ' A' ' 123' ' ' VAL . 44.2 t -51.25 -50.73 58.65 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.295 -1.321 . . . . 0.90000000000000002 109.271 170.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.753 HG12 ' NZ ' ' A' ' 20' ' ' LYS . 86.3 t -63.84 -38.19 81.69 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 CA-C-N 116.252 -0.431 . . . . 1.2 110.514 175.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.469 ' OE2' ' HA ' ' A' ' 110' ' ' LEU . 42.8 mt-10 -56.12 -33.19 64.91 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.977 0.418 . . . . 2.5099999999999998 110.552 176.168 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.534 ' HA ' ' HE2' ' A' ' 119' ' ' MET . 25.1 m -79.73 -41.65 26.24 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.006 -0.543 . . . . 0.28000000000000003 109.557 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.685 HG21 ' O ' ' A' ' 111' ' ' CYS . 99.3 t -68.74 -31.01 49.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.827 0.822 . . . . 1.8300000000000001 109.739 -175.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -55.61 -47.9 75.8 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.015 -1.448 . . . . 0.59999999999999998 110.858 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.445 ' CG ' ' HE3' ' A' ' 119' ' ' MET . 23.8 mmtt -90.2 14.42 12.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.678 -0.692 . . . . 2.1600000000000001 110.325 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 62.25 43.78 8.16 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.74 0.781 . . . . 1.8799999999999999 111.278 -179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.636 ' HE1' HG21 ' A' ' 74' ' ' ILE . 32.8 mtm -115.96 49.33 1.12 Allowed 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.645 -1.242 . . . . 1.0800000000000001 107.645 178.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -67.85 -6.72 22.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.182 -1.372 . . . . 1.1499999999999999 112.455 -171.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.472 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 27.0 m -72.52 -12.79 16.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.935 0.398 . . . . 1.1899999999999999 111.211 175.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.703 HD11 ' HD3' ' A' ' 125' ' ' ARG . 2.9 mm? -83.62 -24.09 31.58 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 109.776 -0.453 . . . . 1.0600000000000001 109.776 176.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.755 HG11 ' HG ' ' A' ' 111' ' ' CYS . 67.4 t -46.9 -55.58 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.783 -0.644 . . . . 1.0 112.223 -178.31 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 12.8 t -73.88 -31.41 63.13 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.729 -0.388 . . . . 1.6599999999999999 110.142 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.703 ' HD3' HD11 ' A' ' 122' ' ' LEU . 11.8 mtp180 -61.23 -58.66 7.37 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 120.859 0.362 . . . . 3.2999999999999998 110.639 178.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.65 HG22 ' SD ' ' A' ' 130' ' ' MET . 71.2 mt -51.77 -52.62 21.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.545 -0.752 . . . . 1.0600000000000001 110.043 179.257 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.806 ' HB3' HD21 ' A' ' 13' ' ' LEU . . . -56.19 -36.31 68.23 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.945 0.402 . . . . 1.1000000000000001 111.627 179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.805 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -63.59 -59.64 4.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.219 0.533 . . . . 1.1200000000000001 110.499 176.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 68.7 m95 -67.36 -22.74 65.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.887 -1.051 . . . . 4.7699999999999996 111.504 -174.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.65 ' SD ' HG22 ' A' ' 126' ' ' ILE . 85.9 mtp -69.24 -54.11 16.44 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.679 0.276 . . . . 1.0900000000000001 111.244 175.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.448 ' N ' HG22 ' A' ' 9' ' ' VAL . . . -67.11 -33.17 74.89 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.506 -0.316 . . . . 1.05 110.844 -177.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 97.6 m -63.8 -45.14 91.04 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.672 -0.411 . . . . 1.1299999999999999 110.884 175.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -57.91 -41.97 83.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.034 0.445 . . . . 3.3500000000000001 110.04 176.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.925 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.5 OUTLIER -57.38 -58.11 9.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.728 -0.669 . . . . 1.5900000000000001 109.663 172.242 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -45.22 -55.28 5.98 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.036 -0.984 . . . . 0.46000000000000002 112.631 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -76.21 -53.33 8.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.994 0.426 . . . . 0.58999999999999997 111.853 -173.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.79 -50.27 5.83 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.774 0.657 . . . . 2.3399999999999999 112.774 -169.241 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.925 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -76.55 -47.35 22.88 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 113.629 0.974 . . . . 1.8999999999999999 113.629 -167.453 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.589 ' HA ' HD11 ' A' ' 142' ' ' ILE . 18.7 tt0 -45.24 -52.36 21.4 Favored Pre-proline 0 CA--C 1.538 0.511 0 O-C-N 123.965 0.791 . . . . 0.75 112.785 -170.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.532 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 31.3 Cg_exo -58.52 -45.21 31.52 Favored 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 121.704 1.603 . . . . 0.87 111.689 178.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . 0.634 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.8 OUTLIER -58.78 -52.07 67.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.174 -0.921 . . . . 1.4299999999999999 110.846 179.137 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.596 HD13 ' NE1' ' A' ' 148' ' ' TRP . 59.1 mt -45.62 -52.52 2.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.661 -0.7 . . . . 1.1299999999999999 111.768 175.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.556 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.7 mm-40 -58.32 -34.44 70.6 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.812 -0.631 . . . . 0.57999999999999996 111.34 -179.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 10.8 mm-40 -64.03 -22.9 67.12 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.118 0.485 . . . . 0.78000000000000003 111.103 177.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.637 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -100.9 -7.45 23.45 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.655 -0.702 . . . . 0.93000000000000005 109.575 -173.554 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 134.99 -36.96 2.0 Allowed Glycine 0 N--CA 1.44 -1.034 0 CA-C-N 115.358 -0.837 . . . . 0.56000000000000005 112.772 176.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 120.16 175.22 15.55 Favored Glycine 0 N--CA 1.449 -0.44 0 N-CA-C 111.146 -0.781 . . . . 0.48999999999999999 111.146 -175.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.596 ' NE1' HD13 ' A' ' 142' ' ' ILE . 4.8 m-90 -67.48 -33.72 75.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.339 0.569 . . . . 4.5199999999999996 111.319 -176.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.405 ' O ' ' HG3' ' A' ' 153' ' ' GLU . 9.7 m-20 -58.98 -40.06 83.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.119 0.485 . . . . 1.96 110.233 177.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.535 ' O ' ' HB2' ' A' ' 153' ' ' GLU . 55.3 m -55.54 -37.33 67.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.392 -0.822 . . . . 1.24 112.224 177.393 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.415 ' HA ' ' HZ2' ' A' ' 97' ' ' TRP . 10.5 m-85 -61.47 -39.84 92.36 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.459 -0.497 . . . . 3.7200000000000002 110.356 -178.652 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.753 HG12 ' HA ' ' A' ' 46' ' ' VAL . 0.8 OUTLIER -75.42 -26.11 18.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.074 -0.512 . . . . 1.8600000000000001 110.004 177.764 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.535 ' HB2' ' O ' ' A' ' 150' ' ' THR . 70.2 mt-10 -58.08 -30.35 66.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.243 -0.435 . . . . 1.6699999999999999 110.483 171.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.507 HD11 ' CE2' ' A' ' 97' ' ' TRP . 3.4 mt -98.65 -56.7 2.38 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.23 -0.441 . . . . 1.96 111.023 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . 0.804 ' HH ' ' HA ' ' B' 1016 ' ' ASN . 3.1 m-85 -120.59 28.47 7.96 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.174 -0.466 . . . . 4.3899999999999997 111.098 -173.528 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.58 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -62.9 157.49 38.9 Favored Glycine 0 CA--C 1.498 -0.997 0 C-N-CA 120.654 -0.784 . . . . 1.1000000000000001 112.699 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.576 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 20.1 t-20 -54.18 113.88 1.41 Allowed 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 114.286 -0.957 . . . . 1.29 109.449 174.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.636 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 0.2 OUTLIER -91.8 2.61 56.39 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.725 -0.39 . . . . 3.4399999999999999 111.441 -171.863 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -53.27 -42.5 66.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.65 0.262 . . . . 2.6699999999999999 111.067 -178.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.561 ' O ' ' HD3' ' A' ' 164' ' ' ARG . . . -69.85 -38.97 76.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.46 -0.336 . . . . 2.8700000000000001 110.891 176.691 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -54.21 -60.88 2.75 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.062 -0.517 . . . . 3.2000000000000002 111.11 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.636 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 5.1 pt-20 -63.67 -33.73 76.27 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.72 -0.673 . . . . 3.7200000000000002 111.651 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' SER . . . . . 0.506 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 29.7 t -61.32 -46.26 91.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.102 0.477 . . . . 4.2000000000000002 110.32 178.266 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . 0.624 ' HA ' HE21 ' A' ' 167' ' ' GLN . 9.2 mpt_? -79.24 -11.34 59.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.113 -0.494 . . . . 6.3700000000000001 110.551 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -84.49 -45.5 12.58 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.828 -0.624 . . . . 5.0099999999999998 110.32 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -64.41 -44.13 95.78 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.817 -0.629 . . . . 5.0999999999999996 112.488 -179.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.624 HE21 ' HA ' ' A' ' 164' ' ' ARG . 26.3 pt20 -75.17 -15.18 60.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.944 0.402 . . . . 5.9400000000000004 111.007 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . 0.567 ' HB2' ' O ' ' A' ' 164' ' ' ARG . 29.2 tt0 -74.02 -10.04 59.23 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.424 0.63 . . . . 5.8799999999999999 109.662 177.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.433 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 1.6 tmt_? -69.0 -37.08 78.51 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.831 -0.803 . . . . 7.7999999999999998 108.831 174.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 170' ' ' LEU . 0.3 OUTLIER -89.29 -46.2 8.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.699 -0.682 . . . . 7.29 109.199 177.497 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -73.98 92.1 2.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.861 -0.609 . . . . 6.9699999999999998 109.527 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -68.69 156.11 38.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.087 -0.506 . . . . 9.8100000000000005 111.034 -175.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -69.23 103.06 1.84 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.908 -0.587 . . . . 11.99 110.439 -177.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -85.8 -20.81 28.63 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.769 -0.65 . . . . 11.949999999999999 110.8 -177.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -73.69 123.65 24.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.168 0.508 . . . . 14.949999999999999 111.2 -176.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 28.8 t60 -80.8 112.66 18.39 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.463 -0.789 . . . . 15.880000000000001 109.515 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -87.18 122.0 30.38 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.978 -0.379 . . . . 16.02 109.978 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 55.8 tp -74.88 123.76 25.65 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.146 -0.479 . . . . 18.210000000000001 110.392 -178.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -113.4 159.16 19.75 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.394 -0.366 . . . . 19.219999999999999 110.338 177.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -69.49 133.22 47.43 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.127 0.489 . . . . 22.800000000000001 110.978 -177.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 29.2 m80 -98.98 -37.59 9.32 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.458 -0.941 . . . . 22.510000000000002 108.458 175.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -133.41 -69.52 0.55 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.95 -1.023 . . . . 25.300000000000001 109.042 171.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -167.64 127.53 1.38 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.628 -0.715 . . . . 25.77 109.843 176.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 32.7 m80 -88.83 137.94 31.86 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.159 -0.312 . . . . 27.370000000000001 110.159 179.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.6 m80 . . . . . 0 C--O 1.247 0.933 0 O-C-N 123.818 0.699 . . . . 29.52 110.241 -176.979 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.202 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -147.78 150.88 23.16 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.883 -0.675 . . . . 2.9900000000000002 112.248 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.451 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . 18.7 m 56.2 -143.26 0.73 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 122.86 0.464 . . . . 1.9399999999999999 110.88 -178.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.899 HG22 ' H ' ' B' 1005 ' ' GLY . 34.1 m 43.15 -92.16 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 124.815 1.246 . . . . 1.9399999999999999 113.522 176.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 1.015 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . -41.19 -31.6 0.56 Allowed Glycine 0 CA--C 1.534 1.223 0 CA-C-N 119.034 0.834 . . . . 1.26 113.588 168.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -86.23 -52.32 5.72 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.462 -0.434 . . . . 3.4500000000000002 111.344 171.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1007 ' ' ALA . . . . . 0.468 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -71.38 -55.02 8.79 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 113.012 0.745 . . . . 1.54 113.012 -170.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.517 HD21 ' HA ' ' B' 1004 ' ' VAL . 3.3 mm? -59.75 -56.52 20.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.584 -0.28 . . . . 1.8999999999999999 110.679 -177.484 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 1.05 ' HB1' ' HB2' ' A' ' 89' ' ' GLU . . . -41.18 -48.83 3.51 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.899 0.749 . . . . 1.45 111.578 173.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.817 ' HB3' ' N11' ' B' 1100 ' ' 33B . . . -65.19 -55.22 19.82 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 114.427 -1.26 . . . . 1.51 111.786 -177.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.635 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 49.7 m-85 -66.05 -24.92 66.83 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.024 0.44 . . . . 2.0699999999999998 110.945 -178.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.44 -5.27 72.17 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.807 -0.633 . . . . 0.80000000000000004 113.07 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 21.7 t70 -80.3 -20.73 43.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.264 0.554 . . . . 1.8999999999999999 110.114 175.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 9.7 m -85.15 34.4 0.56 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.89 -0.595 . . . . 1.4399999999999999 112.121 -172.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 1.057 HG12 ' HA3' ' A' ' 98' ' ' GLY . 1.3 pp -84.47 23.15 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 112.311 0.485 . . . . 3.4300000000000002 112.311 179.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 1016 ' ' ASN . . . . . 0.804 ' HA ' ' HH ' ' A' ' 155' ' ' TYR . 9.8 p30 -161.35 -42.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 O-C-N 122.265 -0.272 . . . . 4.79 111.49 176.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 12.5 ttm180 -125.09 -86.8 0.62 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.764 0.316 . . . . 8.9800000000000004 110.459 -178.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.434 0 O-C-N 122.381 -0.199 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.817 ' N11' ' HB3' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.5 mtm . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 110.426 -0.213 . . . . 6.4500000000000002 110.426 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.9 m 54.59 54.13 9.7 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.405 0.621 . . . . 2.2599999999999998 111.185 -179.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 70.4 mm-40 -70.15 -9.48 55.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.674 -0.694 . . . . 2.7599999999999998 111.141 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.8 p -66.55 -18.99 65.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.107 -0.497 . . . . 1.54 111.473 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.651 ' HB3' ' HG ' ' A' ' 134' ' ' LEU . 72.7 m-20 -64.27 -23.92 67.48 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.072 0.463 . . . . 1.78 110.19 176.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.935 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.2 tpp180 -56.88 -55.49 33.78 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.512 -0.767 . . . . 1.8999999999999999 110.143 175.336 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.642 ' HB3' ' CE ' ' A' ' 47' ' ' LYS . 43.8 mt-10 -53.58 -49.93 66.69 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.409 -1.269 . . . . 0.68000000000000005 111.434 -177.293 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.65 HD21 ' HA ' ' A' ' 5' ' ' ASN . 0.4 OUTLIER -51.91 -33.96 39.38 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.963 -1.017 . . . . 1.8 112.12 178.531 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.576 HG22 ' HE1' ' A' ' 104' ' ' PHE . 64.5 t -78.6 -59.35 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.719 0.771 . . . . 1.0700000000000001 109.485 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.492 HG13 ' CE2' ' A' ' 24' ' ' TRP . 73.3 t -48.32 -57.32 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 114.223 -1.353 . . . . 1.1299999999999999 113.099 -176.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -59.03 -31.77 69.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.698 0.285 . . . . 0.58999999999999997 110.721 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.606 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.6 t80 -75.97 -44.62 38.94 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 116.265 -0.425 . . . . 2.02 110.444 -179.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.892 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.3 mp -60.43 -42.29 95.76 Favored 'General case' 0 CA--C 1.52 -0.185 0 C-N-CA 120.377 -0.529 . . . . 1.0600000000000001 110.363 176.465 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 15.8 t -62.13 -40.2 95.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.097 -0.501 . . . . 1.6000000000000001 109.89 177.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -59.71 -29.84 68.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.601 -0.727 . . . . 1.49 110.769 178.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.542 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 17.4 mmmt -78.6 -50.62 11.19 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.558 0.694 . . . . 1.8400000000000001 110.506 -179.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.599 HD22 ' SG ' ' A' ' 111' ' ' CYS . 12.5 mt -56.52 -28.03 58.94 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 115.444 -0.798 . . . . 1.98 111.853 176.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.7 m -56.29 -44.67 80.06 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 112.362 0.504 . . . . 1.3799999999999999 112.362 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.542 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 14.8 pt20 -75.46 0.12 18.23 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.31 0.576 . . . . 1.51 111.368 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.514 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.6 mmmt -109.53 -30.08 8.1 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.769 0.795 . . . . 2.6499999999999999 109.199 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.99 24.06 9.35 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 114.134 -1.394 . . . . 0.54000000000000004 111.139 178.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -115.2 160.5 19.65 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.079 0.466 . . . . 1.1200000000000001 111.23 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.7 t -101.17 147.65 26.0 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.391 -0.822 . . . . 0.75 109.628 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.492 ' CE2' HG13 ' A' ' 10' ' ' VAL . 0.5 OUTLIER -79.31 -44.53 21.45 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.355 -0.609 . . . . 4.29 109.355 173.773 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.432 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 6.3 p -64.65 -32.94 74.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.384 -0.826 . . . . 1.8600000000000001 111.76 -172.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -59.62 -24.29 63.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.136 0.493 . . . . 1.52 111.698 178.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.554 ' O ' ' HB2' ' A' ' 124' ' ' SER . 22.2 m-85 -120.46 13.57 11.82 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.898 -0.592 . . . . 1.53 110.897 -175.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.558 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 60.3 p -101.11 -178.53 3.77 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.923 0.712 . . . . 2.04 112.923 -170.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.604 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 4.2 t70 -170.54 -26.93 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.324 -1.307 . . . . 2.3100000000000001 109.359 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.65 HG21 ' H ' ' A' ' 31' ' ' GLU . 10.7 m -45.16 -70.68 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-N 114.424 -1.262 . . . . 1.4099999999999999 113.075 -173.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.65 ' H ' HG21 ' A' ' 30' ' ' VAL . 7.9 pt-20 -100.79 2.28 41.06 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.179 -0.675 . . . . 2.7400000000000002 109.179 176.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.604 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.7 tt0 -68.34 -60.36 2.51 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.798 -1.092 . . . . 1.45 111.38 -175.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 48.1 m-80 -92.55 -36.99 12.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.149 -0.478 . . . . 1.8700000000000001 111.1 -172.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.9 ptt180 -103.64 132.57 49.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.186 0.517 . . . . 3.8199999999999998 110.401 175.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 29.9 p -113.34 113.59 25.46 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.668 -0.696 . . . . 2.6699999999999999 110.988 -177.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -131.93 -64.51 0.78 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.484 -0.78 . . . . 3.3399999999999999 110.65 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.49 144.94 95.28 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.347 -0.842 . . . . 2.4399999999999999 110.977 178.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.567 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 25.8 Cg_exo -63.87 177.26 1.93 Allowed 'Trans proline' 0 CA--C 1.529 0.242 0 C-N-CA 122.862 2.375 . . . . 1.8700000000000001 112.007 176.106 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -81.48 13.46 3.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.481 0.657 . . . . 4.6399999999999997 110.389 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 131.2 65.84 0.09 OUTLIER Glycine 0 N--CA 1.441 -1.013 0 CA-C-N 115.284 -0.871 . . . . 2.3999999999999999 111.229 -178.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.873 HG22 ' H ' ' A' ' 42' ' ' GLU . 1.6 t -66.77 -75.12 0.1 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.831 0.348 . . . . 1.45 110.313 -176.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.873 ' H ' HG22 ' A' ' 41' ' ' THR . 3.6 pt-20 -94.15 -28.87 15.44 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.281 1.039 . . . . 2.02 108.48 167.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.424 ' C ' ' HD2' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -56.34 -38.52 71.47 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 112.829 -1.987 . . . . 1.25 113.686 -169.826 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.519 ' HA ' ' CD ' ' A' ' 47' ' ' LYS . 13.8 tp10 -47.9 -56.1 8.33 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 117.903 0.319 . . . . 1.9099999999999999 110.757 -174.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.506 ' HB2' HG21 ' A' ' 152' ' ' VAL . . . -66.14 -40.19 90.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.833 0.349 . . . . 1.1799999999999999 110.743 178.096 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.711 ' HA ' HG13 ' A' ' 152' ' ' VAL . 84.8 t -56.75 -59.94 2.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.572 0.701 . . . . 2.0099999999999998 111.134 178.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.642 ' CE ' ' HB3' ' A' ' 7' ' ' GLU . 4.2 ptmt -64.53 -30.77 71.8 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.811 -1.086 . . . . 1.3799999999999999 109.837 -176.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.749 ' HB3' ' HB3' ' A' ' 157' ' ' ASN . 8.2 mm100 -72.91 -27.35 61.81 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.566 -0.743 . . . . 0.98999999999999999 110.882 177.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.611 ' HB1' ' HA2' ' A' ' 156' ' ' GLY . . . -79.7 -34.61 40.03 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.127 0.489 . . . . 1.1399999999999999 109.814 175.254 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mp -62.73 -35.8 80.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.339 -0.846 . . . . 1.95 112.218 -178.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.545 ' HD3' ' NE2' ' A' ' 48' ' ' GLN . 11.6 ptm180 -68.99 -36.23 77.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.713 0.768 . . . . 2.5099999999999998 109.585 178.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.546 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 6.6 mt-10 -80.74 -37.29 30.75 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.874 -1.057 . . . . 1.1000000000000001 110.811 -174.198 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.42 -34.77 72.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.742 -0.663 . . . . 1.04 109.667 171.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.57 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.92 -50.69 61.55 Favored Glycine 0 C--O 1.223 -0.593 0 CA-C-N 115.342 -0.844 . . . . 0.69999999999999996 112.431 179.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.625 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 28.1 t70 -54.29 -36.36 63.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.24 0.543 . . . . 1.04 111.099 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.47 ' O ' HD13 ' A' ' 59' ' ' LEU . 4.3 tt0 -76.98 -27.6 54.79 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.422 -0.808 . . . . 2.29 110.867 -178.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.475 ' CE1' ' HA2' ' B' 1012 ' ' GLY . 0.1 OUTLIER -82.87 -54.12 5.34 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.773 -0.649 . . . . 2.9300000000000002 111.791 178.965 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.595 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 17.2 mt-10 -55.39 -54.5 42.91 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.975 0.731 . . . . 1.3 112.975 -168.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.689 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -42.48 -41.31 2.9 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.739 1.014 . . . . 2.1899999999999999 113.739 -172.862 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.689 ' H ' HD12 ' A' ' 59' ' ' LEU . 36.4 mtm180 -59.41 -59.45 5.42 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 111.939 0.348 . . . . 3.1400000000000001 111.939 -176.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.595 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -91.77 -5.67 53.14 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.052 0.76 . . . . 5.5899999999999999 113.052 -175.352 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.449 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 24.6 ptt180 -66.42 -15.09 63.05 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 122.246 -0.284 . . . . 4.9299999999999997 111.539 -175.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 63' ' ' ARG . 37.7 mtm105 -67.87 -15.95 63.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.243 -0.435 . . . . 5.3499999999999996 111.438 179.336 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.735 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.38 -35.06 13.91 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.585 0.217 . . . . 1.7 111.585 175.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.647 ' HE1' HD12 ' B' 1008 ' ' LEU . 9.6 m-30 -43.32 -50.53 6.63 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.141 1.163 . . . . 3.52 114.141 -168.064 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.6 m -72.79 -20.53 61.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.101 0.477 . . . . 2.5899999999999999 111.41 -171.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -90.41 -23.98 20.89 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.785 -0.643 . . . . 2.7200000000000002 110.297 178.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.735 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 70.1 mt -77.65 -16.06 58.78 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 113.012 0.745 . . . . 2.25 113.012 -173.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.55 HG21 HG13 ' A' ' 74' ' ' ILE . 3.5 p -56.15 -28.9 59.78 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.27 0.47 . . . . 1.26 112.27 -172.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.2 t -67.37 -36.62 81.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.39 0.614 . . . . 1.8 109.823 175.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.624 ' NE2' HD23 ' A' ' 68' ' ' LEU . 17.1 mt-30 -72.43 -41.59 66.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.321 -0.854 . . . . 1.8899999999999999 109.765 177.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 73' ' ' HIS . 3.5 mm? -65.71 -32.2 73.61 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.05 -0.523 . . . . 1.98 110.921 176.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.427 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 38.6 m80 63.9 40.44 7.41 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.887 -0.783 . . . . 3.54 108.887 -173.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.574 HG23 ' HB3' ' A' ' 113' ' ' GLU . 35.9 mm -49.62 113.74 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-N 114.447 -1.251 . . . . 1.1499999999999999 111.441 -178.198 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.776 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.81 -170.37 0.24 Allowed Pre-proline 0 CA--C 1.548 0.887 0 N-CA-C 107.922 -1.14 . . . . 1.1200000000000001 107.922 -168.633 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.776 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.3 Cg_exo -28.71 166.88 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.089 1 C-N-CA 125.407 4.072 . . . . 0.53000000000000003 115.537 162.857 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.87 -29.18 0.01 OUTLIER Glycine 0 N--CA 1.472 1.053 0 N-CA-C 117.261 1.664 . . . . 0.40999999999999998 117.261 -173.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' A' ' 81' ' ' GLN . 32.9 p -68.51 3.36 1.84 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 117.93 0.865 . . . . 1.22 111.997 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.64 -13.39 61.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.339 0.59 . . . . 1.0700000000000001 109.564 170.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.419 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 50.2 t80 -75.45 -18.43 59.88 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 115.703 -0.68 . . . . 4.3099999999999996 109.234 173.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.502 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 74.2 mt-30 -80.42 -26.99 38.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 122.199 1.0 . . . . 1.03 109.416 172.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m -78.09 -33.05 50.93 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.188 -1.369 . . . . 0.47999999999999998 110.039 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.667 ' HB2' ' HG ' ' A' ' 110' ' ' LEU . 67.7 t80 -80.42 -17.07 52.89 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.583 0.706 . . . . 1.4399999999999999 109.378 172.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.553 ' HA ' HG11 ' A' ' 87' ' ' VAL . 35.3 tt0 -68.2 -57.99 5.14 Favored 'General case' 0 CA--C 1.498 -1.054 0 CA-C-N 115.109 -0.95 . . . . 0.80000000000000004 111.178 -174.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.592 ' HG3' ' H ' ' A' ' 86' ' ' VAL . 3.2 pt20 -43.95 -38.88 3.69 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 113.557 -1.656 . . . . 1.99 110.932 178.236 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.592 ' H ' ' HG3' ' A' ' 85' ' ' GLN . 1.5 t -78.28 -53.94 13.11 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.734 0 CA-C-N 112.465 -2.152 . . . . 1.8999999999999999 111.142 -177.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.553 HG11 ' HA ' ' A' ' 84' ' ' GLU . 8.6 p -60.73 -21.61 24.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 122.057 0.932 . . . . 1.4299999999999999 109.445 -178.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.454 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 2.7 m-80 -70.96 -43.77 67.42 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 113.897 -1.501 . . . . 0.91000000000000003 111.34 173.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.682 ' OE1' ' HA ' ' B' 1009 ' ' ALA . 2.0 pp20? -73.01 -37.56 66.92 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 121.767 0.794 . . . . 2.8700000000000001 109.055 177.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.885 HD13 HH11 ' A' ' 99' ' ' ARG . 3.5 tp -66.74 -19.82 65.83 Favored 'General case' 0 N--CA 1.433 -1.31 0 CA-C-N 113.731 -1.577 . . . . 1.9199999999999999 112.015 -165.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.639 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 2.6 p90 -110.64 -28.82 8.29 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 120.524 -0.471 . . . . 2.9700000000000002 112.0 -173.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.518 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 9.9 ptm180 -72.94 -39.31 66.33 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.289 0.566 . . . . 5.6699999999999999 111.534 -171.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -88.93 13.44 12.76 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.269 -0.878 . . . . 3.1200000000000001 113.361 -169.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.573 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 128.46 70.66 0.14 Allowed Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 116.952 -2.547 . . . . 2.3100000000000001 115.459 178.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.639 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 75.0 t -72.06 104.48 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 118.417 1.109 . . . . 1.6799999999999999 111.066 178.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -111.24 -170.22 1.6 Allowed 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.224 -1.353 . . . . 2.1200000000000001 108.712 177.793 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 10.8 m-90 -56.1 -46.35 79.11 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 123.515 0.509 . . . . 4.1200000000000001 111.192 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.75 ' HA3' HG23 ' B' 1015 ' ' ILE . . . -79.05 -30.62 46.13 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.957 -0.64 . . . . 0.80000000000000004 113.938 -175.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.885 HH11 HD13 ' A' ' 90' ' ' LEU . 16.6 mmt180 -55.61 -42.44 74.89 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 117.216 0.508 . . . . 4.9100000000000001 111.553 -178.03 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.563 HG21 ' CE2' ' A' ' 104' ' ' PHE . 55.0 mt -67.8 -38.57 80.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.969 -0.56 . . . . 1.1100000000000001 110.678 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 52.0 t -53.97 -54.18 22.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.937 -0.574 . . . . 2.0299999999999998 110.033 172.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -55.68 -40.62 72.56 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.503 -0.772 . . . . 1.0600000000000001 111.227 177.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -58.9 -40.96 86.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.372 -0.831 . . . . 1.8400000000000001 111.069 177.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.576 ' HE1' HG22 ' A' ' 9' ' ' VAL . 39.1 m-85 -71.11 -34.09 70.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.694 0.283 . . . . 4.21 110.506 175.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.606 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 25.3 t -58.95 -57.49 12.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.078 -0.51 . . . . 1.55 111.127 178.165 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.494 ' CE2' HG21 ' A' ' 86' ' ' VAL . 34.6 t80 -68.11 -31.89 71.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 3.6400000000000001 110.231 -178.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.48 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -67.3 -46.21 73.09 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.786 -0.721 . . . . 0.32000000000000001 111.785 177.208 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.892 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.56 -31.98 81.84 Favored Glycine 0 N--CA 1.441 -0.982 0 C-N-CA 120.646 -0.787 . . . . 0.23999999999999999 111.148 176.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.45 -30.56 67.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.577 -0.311 . . . . 1.05 110.526 175.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.667 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -65.02 -42.54 94.3 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 107.974 -1.121 . . . . 1.78 107.974 178.795 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.7 ' SG ' HG21 ' A' ' 123' ' ' VAL . 38.2 t -52.74 -54.8 28.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.101 -1.409 . . . . 0.90000000000000002 110.479 172.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.514 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 73.8 t -62.97 -42.78 97.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.202 -0.453 . . . . 1.2 111.864 -177.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.574 ' HB3' HG23 ' A' ' 74' ' ' ILE . 3.4 mm-40 -59.08 -29.13 67.11 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.606 -0.438 . . . . 2.5099999999999998 110.991 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.433 ' HA ' ' HE3' ' A' ' 119' ' ' MET . 47.7 m -73.31 -39.23 65.45 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.963 -0.754 . . . . 0.28000000000000003 108.963 176.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.622 HG21 ' O ' ' A' ' 111' ' ' CYS . 80.5 t -67.07 -38.13 80.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.213 -0.903 . . . . 1.8300000000000001 109.397 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -52.75 -50.44 63.48 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 113.364 -1.744 . . . . 0.59999999999999998 111.338 -179.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.472 ' HZ1' HG22 ' A' ' 69' ' ' THR . 20.7 mmtt -88.18 16.18 6.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.137 -0.483 . . . . 2.1600000000000001 110.394 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.495 ' HA ' ' NE2' ' A' ' 120' ' ' GLN . 45.5 mt-10 63.87 49.32 2.89 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.82 0.819 . . . . 1.8799999999999999 110.729 178.276 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.506 ' HE2' HG22 ' A' ' 74' ' ' ILE . 26.4 mtm -130.67 44.69 2.92 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.627 -1.17 . . . . 1.0800000000000001 108.203 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.612 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 3.4 mp0 -62.45 -6.99 3.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.283 -0.871 . . . . 1.1499999999999999 112.958 -173.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.572 HG23 HD23 ' A' ' 122' ' ' LEU . 26.6 m -66.01 -21.85 29.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 O-C-N 122.14 -0.35 . . . . 1.1899999999999999 111.577 176.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.68 HD12 ' HD3' ' A' ' 125' ' ' ARG . 3.3 mm? -75.53 -25.24 57.02 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 110.291 -0.263 . . . . 1.0600000000000001 110.291 178.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.7 HG21 ' SG ' ' A' ' 111' ' ' CYS . 49.6 t -43.86 -53.63 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 123.917 0.761 . . . . 1.0 112.059 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.558 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 12.6 t -71.99 -37.77 69.8 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.853 -0.339 . . . . 1.6599999999999999 110.718 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.68 ' HD3' HD12 ' A' ' 122' ' ' LEU . 63.7 mtp180 -61.0 -56.52 20.11 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.305 -0.407 . . . . 3.2999999999999998 110.512 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.582 HG21 ' SD ' ' A' ' 130' ' ' MET . 70.7 mt -52.25 -50.67 36.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.807 -0.633 . . . . 1.0600000000000001 110.305 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.789 ' HB1' HD21 ' A' ' 13' ' ' LEU . . . -57.18 -36.17 70.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.851 0.358 . . . . 1.1000000000000001 111.378 179.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.935 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -63.54 -57.69 9.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.311 0.577 . . . . 1.1200000000000001 110.556 176.137 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -66.72 -26.9 67.23 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.719 -1.128 . . . . 4.7699999999999996 111.197 -174.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.582 ' SD ' HG21 ' A' ' 126' ' ' ILE . 89.7 mtp -69.23 -53.99 17.05 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.081 0.467 . . . . 1.0900000000000001 110.972 175.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.481 ' CA ' HG23 ' A' ' 9' ' ' VAL . . . -59.33 -39.26 82.59 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.8 -0.636 . . . . 1.05 111.073 -178.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 86.7 m -63.56 -47.32 82.04 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.763 -0.375 . . . . 1.1299999999999999 111.022 176.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.581 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 12.1 t80 -55.43 -39.35 70.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.178 0.514 . . . . 3.3500000000000001 109.847 178.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.848 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.3 OUTLIER -59.91 -60.71 3.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.821 -0.627 . . . . 1.5900000000000001 109.855 170.833 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -45.94 -44.36 14.72 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.054 -0.975 . . . . 0.46000000000000002 113.245 -179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -86.14 -51.87 6.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.989 0.423 . . . . 0.58999999999999997 112.047 -178.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . 0.581 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 8.7 m80 -89.54 -49.7 6.52 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.889 0.7 . . . . 2.3399999999999999 112.889 -168.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.848 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -76.71 -44.82 31.94 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 113.0 0.741 . . . . 1.8999999999999999 113.0 -169.906 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.616 ' HA ' HD11 ' A' ' 142' ' ' ILE . 17.6 tt0 -42.23 -53.57 8.6 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.106 -0.952 . . . . 0.75 113.254 -171.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.534 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 24.3 Cg_exo -63.11 -42.55 22.76 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 121.76 1.64 . . . . 0.87 111.634 178.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . 0.493 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -56.8 -48.71 77.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.283 -0.871 . . . . 1.4299999999999999 110.421 177.514 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.616 HD11 ' HA ' ' A' ' 139' ' ' GLU . 42.6 mt -49.76 -49.71 19.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.266 -0.879 . . . . 1.1299999999999999 111.455 175.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.549 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.5 mm-40 -58.86 -32.64 69.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.543 -0.753 . . . . 0.57999999999999996 111.355 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.1 mm-40 -66.42 -19.45 65.8 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.304 0.574 . . . . 0.78000000000000003 111.1 176.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.608 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -108.0 3.25 23.86 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.469 -0.787 . . . . 0.93000000000000005 109.522 -175.759 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.32 -49.17 0.89 Allowed Glycine 0 N--CA 1.44 -1.081 0 CA-C-N 115.156 -0.929 . . . . 0.56000000000000005 112.764 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . 0.435 ' O ' ' HB ' ' A' ' 150' ' ' THR . . . 139.66 178.95 17.19 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.765 -0.731 . . . . 0.48999999999999999 111.757 -177.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.603 ' HZ2' ' HG3' ' A' ' 139' ' ' GLU . 19.0 m-90 -68.41 -42.53 78.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.694 0.283 . . . . 4.5199999999999996 110.614 -178.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.448 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 3.5 m-20 -57.75 -33.91 68.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 1.96 110.369 176.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.537 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 50.2 m -59.71 -40.77 89.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.116 -0.493 . . . . 1.24 111.488 178.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.55 ' CD2' ' HA ' ' A' ' 148' ' ' TRP . 19.5 m-85 -59.75 -36.16 76.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.248 0.547 . . . . 3.7200000000000002 109.756 -178.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.711 HG13 ' HA ' ' A' ' 46' ' ' VAL . 1.4 m -81.28 -24.54 10.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.652 -0.703 . . . . 1.8600000000000001 110.17 178.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' A' ' 150' ' ' THR . 11.2 mm-40 -59.19 -26.68 65.01 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.123 0.487 . . . . 1.6699999999999999 109.964 171.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 150' ' ' THR . 1.4 mt -97.53 -55.22 2.89 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.718 -0.673 . . . . 1.96 110.737 179.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 56.3 m-85 -112.47 16.98 19.65 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.059 -0.518 . . . . 4.3899999999999997 111.749 -170.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.611 ' HA2' ' HB1' ' A' ' 49' ' ' ALA . . . -63.8 159.77 38.74 Favored Glycine 0 CA--C 1.497 -1.071 0 CA-C-O 122.605 1.114 . . . . 1.1000000000000001 115.164 -168.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.749 ' HB3' ' HB3' ' A' ' 48' ' ' GLN . 46.5 t-20 -114.03 146.03 40.75 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 112.599 -1.8 . . . . 1.29 109.68 -174.343 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.557 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 1.6 p-10 -95.5 16.34 17.31 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.986 -0.286 . . . . 3.4399999999999999 111.239 -176.863 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -50.15 -42.49 50.95 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.15 -0.477 . . . . 2.6699999999999999 111.938 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -77.09 -35.66 56.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.689 0.28 . . . . 2.8700000000000001 110.432 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -54.95 -58.24 8.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.896 -0.593 . . . . 3.2000000000000002 111.326 177.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.557 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 4.2 pt-20 -64.73 -33.52 76.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.956 -0.566 . . . . 3.7200000000000002 111.411 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 33.3 t -63.5 -45.73 89.33 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.034 0.445 . . . . 4.2000000000000002 109.955 178.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -75.07 -16.92 60.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.212 0.53 . . . . 6.3700000000000001 110.801 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -77.86 -19.79 54.21 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.309 -0.859 . . . . 5.0099999999999998 110.589 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -52.58 -49.48 52.52 Favored Glycine 0 C--N 1.331 0.268 0 CA-C-N 115.961 -0.563 . . . . 5.0999999999999996 113.624 -174.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -75.21 -23.98 57.69 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.088 0.47 . . . . 5.9400000000000004 111.293 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -84.3 3.25 36.44 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.163 0.506 . . . . 5.8799999999999999 110.199 -179.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.644 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 3.0 tmt_? -82.57 -17.84 43.44 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.527 -0.916 . . . . 7.7999999999999998 108.527 175.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -86.18 7.44 25.01 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.312 -0.858 . . . . 7.29 110.48 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 66.82 -176.97 0.2 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.59 -0.732 . . . . 6.9699999999999998 111.548 177.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 -137.04 137.51 39.44 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.103 -0.499 . . . . 9.8100000000000005 110.132 177.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -114.36 131.35 56.58 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.75 -0.463 . . . . 11.99 109.75 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . 0.495 ' CE1' ' HB2' ' A' ' 177' ' ' HIS . 60.3 t60 -86.94 94.84 9.71 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.964 0.411 . . . . 11.949999999999999 110.103 -179.13 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 71.5 t60 -109.94 -39.32 5.1 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.035 -0.529 . . . . 14.949999999999999 109.933 177.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -143.76 114.03 7.41 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.092 -0.503 . . . . 15.880000000000001 110.109 -178.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . 0.495 ' HB2' ' CE1' ' A' ' 174' ' ' HIS . 55.8 t-80 -90.39 129.98 36.52 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.751 -0.462 . . . . 16.02 109.751 177.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.433 HD23 ' N ' ' A' ' 178' ' ' LEU . 1.8 pt? -132.48 135.12 45.82 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.743 -0.466 . . . . 18.210000000000001 109.743 178.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -120.11 -45.01 2.47 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.033 0.444 . . . . 19.219999999999999 110.148 -178.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 15.8 m-70 -82.25 122.28 27.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.989 -0.55 . . . . 22.800000000000001 110.147 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -69.31 -26.51 64.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.942 0.401 . . . . 22.510000000000002 110.439 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 29.6 m-70 -74.28 105.54 5.51 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.523 -0.547 . . . . 25.300000000000001 109.523 172.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 29.2 m80 -91.02 87.77 6.73 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.187 -0.461 . . . . 25.77 110.134 -174.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 74.15 -9.59 1.25 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.673 -0.694 . . . . 27.370000000000001 111.509 177.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 11.2 p80 . . . . . 0 C--O 1.245 0.854 0 CA-C-O 118.252 -0.88 . . . . 29.52 110.076 176.254 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B 1001 ' ' ACE . . . . . 0.501 ' O ' ' HD3' ' B' 1006 ' ' ARG . . . . . . . . 0 C--O 1.234 0.257 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -81.33 -28.88 42.54 Favored Glycine 0 N--CA 1.451 -0.349 0 O-C-N 121.555 -0.715 . . . . 2.9900000000000002 112.018 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.64 ' HA ' ' C2 ' ' B' 1100 ' ' 33B . 14.1 m -110.78 -160.79 0.73 Allowed 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 110.189 -0.3 . . . . 1.9399999999999999 110.189 178.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.504 ' HA ' HD23 ' B' 1008 ' ' LEU . 0.8 OUTLIER 39.81 -87.65 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 O-C-N 124.708 1.255 . . . . 1.9399999999999999 113.536 175.41 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . -29.82 -44.05 0.06 OUTLIER Glycine 0 CA--C 1.532 1.124 0 CA-C-N 117.844 0.293 . . . . 1.26 113.829 161.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1006 ' ' ARG . . . . . 0.501 ' HD3' ' O ' ' B' 1001 ' ' ACE . 3.4 mpt_? -98.43 -13.59 20.51 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 113.027 0.751 . . . . 3.4500000000000002 113.027 177.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -97.13 -53.09 3.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.306 0.484 . . . . 1.54 112.306 -170.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.647 HD12 ' HE1' ' A' ' 65' ' ' PHE . 2.7 mm? -64.38 -46.93 81.24 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.832 -0.803 . . . . 1.8999999999999999 108.832 178.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 0.682 ' HA ' ' OE1' ' A' ' 89' ' ' GLU . . . -38.96 -51.8 1.79 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.326 -1.306 . . . . 1.45 111.739 167.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.841 ' HB3' ' N11' ' B' 1100 ' ' 33B . . . -77.67 -55.6 5.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.536 -1.211 . . . . 1.51 111.975 -173.285 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.661 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 53.0 m-85 -66.02 -21.74 66.41 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.157 -0.474 . . . . 2.0699999999999998 110.692 -178.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B 1012 ' ' GLY . . . . . 0.475 ' HA2' ' CE1' ' A' ' 57' ' ' PHE . . . -80.27 -5.61 89.64 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.836 -0.62 . . . . 0.80000000000000004 112.796 -179.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.8 t70 -82.65 -8.78 59.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.323 0.583 . . . . 1.8999999999999999 109.892 174.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 3.2 m -100.01 87.36 3.47 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.488 -0.93 . . . . 1.4399999999999999 108.488 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.75 HG23 ' HA3' ' A' ' 98' ' ' GLY . 18.0 mt -102.87 -78.45 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 116.283 -0.417 . . . . 3.4300000000000002 111.077 -171.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 44.4 t30 -131.11 91.0 2.97 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.079 -0.51 . . . . 4.79 110.628 -175.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -122.21 -74.06 0.63 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.997 -0.547 . . . . 8.9800000000000004 110.313 178.087 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.648 -0.251 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.841 ' N11' ' HB3' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.639 ' HE3' ' HB3' ' A' ' 135' ' ' ASN . 86.1 mtp . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 120.832 0.349 . . . . 6.4500000000000002 110.092 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.4 m -95.47 157.27 15.97 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.647 -0.501 . . . . 2.2599999999999998 109.647 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 -100.08 -7.85 24.45 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.884 0.373 . . . . 2.7599999999999998 110.153 179.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.7 p -60.27 -23.29 64.01 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.838 -0.619 . . . . 1.54 112.03 -179.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.555 ' HA ' HD23 ' A' ' 8' ' ' LEU . 3.9 p30 -67.58 -22.32 65.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.931 -0.577 . . . . 1.78 111.115 176.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.821 HH12 ' HA ' ' A' ' 128' ' ' ALA . 23.9 tpp180 -58.23 -50.69 72.67 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.235 0.541 . . . . 1.8999999999999999 109.864 175.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.711 ' OE1' ' HA2' ' A' ' 40' ' ' GLY . 33.6 mt-10 -50.62 -55.71 15.13 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.324 -1.307 . . . . 0.68000000000000005 110.808 -179.084 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.627 HD12 HG13 ' A' ' 46' ' ' VAL . 2.8 mp -43.61 -45.97 7.01 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.151 -0.931 . . . . 1.8 111.345 176.694 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.5 t -70.2 -60.74 2.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.121 0.486 . . . . 1.0700000000000001 110.662 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.469 HG22 ' O ' ' A' ' 6' ' ' ARG . 63.7 t -53.57 -53.46 25.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.482 -0.781 . . . . 1.1299999999999999 112.477 -175.275 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -54.25 -35.37 62.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.483 -0.78 . . . . 0.58999999999999997 111.126 -175.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.566 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 15.2 t80 -88.34 -37.33 16.03 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 120.478 -0.489 . . . . 2.02 112.14 -175.538 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.989 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 2.8 mp -60.43 -36.93 79.34 Favored 'General case' 0 CA--C 1.521 -0.152 0 C-N-CA 119.386 -0.926 . . . . 1.0600000000000001 109.301 176.277 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.5 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 35.7 t -63.35 -37.37 87.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.642 -0.708 . . . . 1.6000000000000001 110.354 175.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -71.41 -26.09 62.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.666 -0.697 . . . . 1.49 110.48 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.69 ' HZ1' ' HH ' ' A' ' 61' ' ' TYR . 12.8 mmmt -75.86 -43.15 47.06 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 112.133 0.42 . . . . 1.8400000000000001 112.133 -179.227 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.57 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -59.53 -19.08 45.74 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.672 0.272 . . . . 1.98 111.327 177.139 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.1 t -60.37 -44.32 95.71 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.322 0.489 . . . . 1.3799999999999999 112.322 -176.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -66.97 -10.54 50.51 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.631 0.729 . . . . 1.51 111.673 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.549 ' HG3' HG13 ' A' ' 112' ' ' VAL . 19.8 mmmt -105.85 -30.2 9.53 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 122.079 0.942 . . . . 2.6499999999999999 108.936 -177.286 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.17 19.34 21.6 Favored Glycine 0 N--CA 1.442 -0.948 0 CA-C-N 114.297 -1.32 . . . . 0.54000000000000004 111.622 175.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -102.38 162.88 12.57 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.771 0.319 . . . . 1.1200000000000001 110.852 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.2 t -98.11 149.86 22.06 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 115.961 -0.563 . . . . 0.75 110.397 178.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.597 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 52.4 t-105 -77.84 -52.72 8.44 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.225 -0.898 . . . . 4.29 109.968 174.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.7 m -68.49 -22.16 64.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.823 -0.626 . . . . 1.8600000000000001 112.248 -172.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -67.2 -27.69 67.47 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.745 -0.382 . . . . 1.52 111.73 178.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -115.58 -8.48 12.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.215 -0.448 . . . . 1.53 111.894 -174.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.591 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 49.5 m -101.66 154.34 18.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.715 0.769 . . . . 2.04 113.066 -174.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.496 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.8 t70 -115.58 -14.8 11.48 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 113.879 -1.509 . . . . 2.3100000000000001 109.828 -179.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.648 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.0 m -48.48 -73.01 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.463 -1.244 . . . . 1.4099999999999999 113.092 -167.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.648 ' H ' HG23 ' A' ' 30' ' ' VAL . 44.2 mt-10 -92.14 0.89 57.47 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.561 -0.533 . . . . 2.7400000000000002 109.561 176.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.9 tt0 -64.18 -51.14 65.24 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.547 -0.751 . . . . 1.45 110.482 -178.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -101.07 -75.89 0.58 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.95 -0.568 . . . . 1.8700000000000001 111.043 -176.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -79.82 161.43 25.66 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.506 -0.316 . . . . 3.8199999999999998 110.19 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.1 p -129.96 98.33 4.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.511 0.672 . . . . 2.6699999999999999 110.978 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.994 ' HG3' ' H ' ' A' ' 37' ' ' ALA . 6.2 pt-20 -95.64 -83.37 0.37 Allowed 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.095 -0.957 . . . . 3.3399999999999999 111.103 -179.209 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.994 ' H ' ' HG3' ' A' ' 36' ' ' GLU . . . -62.82 137.85 96.88 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 114.697 -1.138 . . . . 2.4399999999999999 111.941 178.103 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.785 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 38.5 Cg_exo -62.12 174.26 2.66 Favored 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 123.172 2.582 . . . . 1.8700000000000001 111.691 173.279 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -74.19 -7.5 52.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.122 0.487 . . . . 4.6399999999999997 110.609 179.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.711 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 160.07 69.16 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.651 -0.704 . . . . 2.3999999999999999 111.55 179.166 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.828 HG21 ' H ' ' A' ' 42' ' ' GLU . 2.2 t -72.75 -75.55 0.14 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 120.456 -0.498 . . . . 1.45 111.022 -173.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.828 ' H ' HG21 ' A' ' 41' ' ' THR . 13.9 pt-20 -92.91 -30.99 15.11 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 122.374 1.083 . . . . 2.02 109.454 174.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.795 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 66.3 m -69.84 -16.63 63.29 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 113.218 -1.81 . . . . 1.25 114.323 -167.159 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -42.81 -41.85 3.39 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 118.254 0.479 . . . . 1.9099999999999999 111.831 -178.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.4 ' HB3' HG21 ' A' ' 152' ' ' VAL . . . -83.65 -42.29 16.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.075 0.464 . . . . 1.1799999999999999 110.47 174.26 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.73 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 75.9 t -46.95 -66.91 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 C-N-CA 124.05 0.94 . . . . 2.0099999999999998 111.857 175.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.795 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.7 ptpt -61.27 -38.1 85.52 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.742 -0.663 . . . . 1.3799999999999999 110.462 -177.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.74 HE21 ' HA ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.61 -27.23 66.12 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 116.233 -0.44 . . . . 0.98999999999999999 110.958 175.365 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.743 ' HB1' ' HA2' ' A' ' 156' ' ' GLY . . . -83.84 -45.75 12.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.235 0.541 . . . . 1.1399999999999999 110.413 172.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.664 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -49.05 -42.25 37.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.826 -1.079 . . . . 1.95 112.003 -179.697 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.638 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.4 ptp180 -76.88 -28.45 55.4 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.336 0.589 . . . . 2.5099999999999998 110.017 -170.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.43 ' HG2' ' HG3' ' A' ' 51' ' ' ARG . 19.1 mm-40 -77.85 -44.18 28.05 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.911 -1.041 . . . . 1.1000000000000001 110.182 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.21 -43.46 98.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.665 -0.698 . . . . 1.04 109.695 174.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.681 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.87 -41.46 99.87 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-N 115.556 -0.747 . . . . 0.69999999999999996 111.48 175.054 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -52.56 -39.3 61.32 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 122.786 0.434 . . . . 1.04 111.123 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -80.05 -27.19 39.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.12 -0.491 . . . . 2.29 111.498 178.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.891 ' HZ ' ' HA2' ' B' 1012 ' ' GLY . 1.4 t80 -80.84 -27.46 36.46 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.537 -0.301 . . . . 2.9300000000000002 111.235 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.784 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 47.7 mt-10 -56.26 -65.48 0.6 Allowed 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 111.932 0.345 . . . . 1.3 111.932 -176.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.746 HD22 ' N ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -52.05 -35.44 47.31 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.323 0.39 . . . . 2.1899999999999999 111.337 -178.616 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.746 ' N ' HD22 ' A' ' 59' ' ' LEU . 46.0 mtt180 -52.83 -55.18 24.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.58 -0.736 . . . . 3.1400000000000001 111.756 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.784 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 29.3 p90 -90.78 -19.68 23.21 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.682 -0.407 . . . . 5.5899999999999999 111.757 -177.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -58.81 -30.11 67.39 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 122.681 0.392 . . . . 4.9299999999999997 111.55 -174.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -62.64 -37.16 85.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 5.3499999999999996 110.685 178.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.403 ' HB2' HD13 ' A' ' 68' ' ' LEU . . . -90.41 -31.23 16.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.426 . . . . 1.7 110.807 178.115 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.573 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 56.9 t80 -42.55 -48.47 5.34 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.821 0.848 . . . . 3.52 113.199 -174.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.5 t -62.75 -38.14 89.37 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.861 0.362 . . . . 2.5899999999999999 110.945 -174.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -87.57 -28.14 22.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.0 0.429 . . . . 2.7200000000000002 110.762 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.628 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 0.5 OUTLIER -60.13 -22.5 62.91 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 113.099 0.777 . . . . 2.25 113.099 -175.349 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.466 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 4.8 p -52.99 -26.99 17.09 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 117.999 0.363 . . . . 1.26 111.391 -179.549 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.7 t -58.98 -58.25 9.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.377 0.608 . . . . 1.8 110.055 173.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.835 ' NE2' ' H ' ' A' ' 71' ' ' GLN . 1.9 mp0 -51.35 -45.59 62.41 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 124.397 1.079 . . . . 1.8899999999999999 111.161 174.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.479 ' HB3' ' CD1' ' A' ' 74' ' ' ILE . 2.4 mm? -66.62 -31.86 72.82 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 116.056 -0.52 . . . . 1.98 111.834 179.082 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.9 m80 57.1 42.64 25.49 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.65 -0.87 . . . . 3.54 108.65 -174.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.503 HG23 ' HB3' ' A' ' 113' ' ' GLU . 31.9 mm -49.67 115.66 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 113.582 -1.644 . . . . 1.1499999999999999 113.141 -173.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.769 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -157.04 -171.61 0.29 Allowed Pre-proline 0 CA--C 1.551 0.988 0 CA-C-N 114.272 -1.331 . . . . 1.1200000000000001 107.798 -171.796 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.769 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 41.0 Cg_exo -28.63 166.67 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.335 1 C-N-CA 125.453 4.102 . . . . 0.53000000000000003 115.976 164.895 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.404 ' HA2' ' CD1' ' A' ' 122' ' ' LEU . . . -31.5 -27.17 0.01 OUTLIER Glycine 0 N--CA 1.474 1.203 0 N-CA-C 117.441 1.737 . . . . 0.40999999999999998 117.441 -173.078 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.432 ' N ' ' O ' ' A' ' 76' ' ' PRO . 24.1 p -69.39 4.34 1.81 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 117.888 0.844 . . . . 1.22 112.007 -179.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.19 -14.58 63.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 121.393 0.616 . . . . 1.0700000000000001 109.742 172.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -76.6 -14.73 59.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.687 -0.688 . . . . 4.3099999999999996 109.92 176.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.48 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 37.3 mt-30 -86.99 -24.11 24.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.623 0.725 . . . . 1.03 109.978 173.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.0 m -71.22 -51.19 26.08 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.711 -1.131 . . . . 0.47999999999999998 109.249 170.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -68.2 -15.94 63.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.82 -1.082 . . . . 1.4399999999999999 110.202 174.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.623 ' HA ' HG11 ' A' ' 87' ' ' VAL . 41.5 tt0 -64.22 -50.55 67.6 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.172 0.51 . . . . 0.80000000000000004 110.257 176.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.475 ' OE1' HG23 ' B' 1004 ' ' VAL . 53.4 mt-30 -44.43 -43.63 7.87 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 114.414 -1.266 . . . . 1.99 111.302 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.66 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.6 p -91.45 -36.77 8.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 CA-C-N 113.546 -1.661 . . . . 1.8999999999999999 112.039 -171.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.623 HG11 ' HA ' ' A' ' 84' ' ' GLU . 6.9 p -66.38 -21.31 28.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 121.845 0.831 . . . . 1.4299999999999999 109.277 175.333 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.607 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.5 m-80 -72.74 -51.47 19.04 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.193 -1.367 . . . . 0.91000000000000003 111.137 175.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 1.041 ' HG2' ' HA2' ' B' 1005 ' ' GLY . 0.0 OUTLIER -64.96 -40.04 94.39 Favored 'General case' 0 CA--C 1.496 -1.109 0 N-CA-C 108.77 -0.826 . . . . 2.8700000000000001 108.77 -178.622 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.596 ' HG ' ' OE1' ' A' ' 89' ' ' GLU . 15.5 mt -57.21 -27.08 61.68 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-N 113.851 -1.522 . . . . 1.9199999999999999 110.8 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.602 ' HA ' HG23 ' A' ' 95' ' ' VAL . 76.4 t80 -97.4 -49.05 5.06 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.341 0.591 . . . . 2.9700000000000002 110.727 -171.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.607 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER -75.56 -32.77 60.52 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.595 -0.73 . . . . 5.6699999999999999 110.885 -173.095 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.509 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 1.4 m-20 -94.55 20.17 8.81 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.676 -0.693 . . . . 3.1200000000000001 112.549 -174.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.69 70.97 0.11 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 117.182 -2.437 . . . . 2.3100000000000001 116.116 177.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 1.051 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 46.6 t -75.88 98.86 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 118.927 1.363 . . . . 1.6799999999999999 111.271 171.714 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -113.35 -170.94 1.78 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.953 -1.021 . . . . 2.1200000000000001 109.601 177.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.674 ' HA ' ' CE2' ' A' ' 151' ' ' PHE . 13.6 m-90 -61.79 -46.7 88.42 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.112 -0.495 . . . . 4.1200000000000001 110.643 178.297 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.46 ' HA3' HG12 ' B' 1015 ' ' ILE . . . -78.54 -20.37 71.73 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.89 -0.595 . . . . 0.80000000000000004 113.9 -174.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 1.051 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -68.91 -30.57 69.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 117.336 0.568 . . . . 4.9100000000000001 110.0 -176.335 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 85.4 mt -76.76 -32.36 20.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.329 -0.396 . . . . 1.1100000000000001 110.642 -178.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.444 ' HA ' ' CD1' ' A' ' 104' ' ' PHE . 0.8 OUTLIER -63.84 -26.48 40.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-O 121.321 0.581 . . . . 2.0299999999999998 109.51 172.038 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -73.77 -49.24 26.37 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.396 -0.594 . . . . 1.0600000000000001 109.396 173.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.66 ' HB2' ' NH1' ' A' ' 99' ' ' ARG . 32.7 t80 -49.93 -55.42 14.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.731 -1.122 . . . . 1.8400000000000001 111.697 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.866 ' HA ' ' HE1' ' A' ' 130' ' ' MET . 0.2 OUTLIER -72.54 -18.46 61.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.974 0.416 . . . . 4.21 110.733 -174.278 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.549 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 23.0 t -81.75 -44.32 17.18 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.219 -0.446 . . . . 1.55 110.524 177.475 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.555 ' CZ ' HD11 ' B' 1008 ' ' LEU . 19.9 m-30 -65.41 -39.92 92.74 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 116.441 -0.345 . . . . 3.6400000000000001 110.107 178.556 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . 0.827 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -64.49 -37.25 94.19 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.821 -0.704 . . . . 0.32000000000000001 111.673 176.695 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.989 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.9 -34.56 87.5 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 120.539 -0.839 . . . . 0.23999999999999999 111.407 175.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.573 ' HB2' ' CE1' ' A' ' 65' ' ' PHE . . . -72.23 -34.1 68.06 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.8 0.333 . . . . 1.05 110.463 176.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.555 ' HB3' HD12 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -60.65 -40.14 90.93 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 122.21 1.005 . . . . 1.78 108.514 179.564 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.656 ' SG ' HG23 ' A' ' 123' ' ' VAL . 33.3 t -52.74 -53.92 41.11 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 113.74 -1.573 . . . . 0.90000000000000002 110.344 173.322 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.549 HG13 ' HG3' ' A' ' 20' ' ' LYS . 54.4 t -61.21 -42.32 92.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.031 -0.531 . . . . 1.2 111.54 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.503 ' HB3' HG23 ' A' ' 74' ' ' ILE . 32.1 mt-10 -55.41 -34.11 64.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.053 0.454 . . . . 2.5099999999999998 110.797 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.434 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 30.3 m -74.14 -38.09 63.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.466 0.65 . . . . 0.28000000000000003 109.268 178.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.619 ' HA ' ' HG3' ' A' ' 120' ' ' GLN . 85.9 t -67.51 -34.29 67.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 115.127 -0.942 . . . . 1.8300000000000001 109.538 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.48 -50.31 60.1 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.594 -1.639 . . . . 0.59999999999999998 111.381 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.422 ' CG ' ' HE3' ' A' ' 119' ' ' MET . 10.6 mmtp -89.74 11.9 18.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.03 -0.532 . . . . 2.1600000000000001 110.541 -179.012 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 61.8 56.29 2.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.93 0.871 . . . . 1.8799999999999999 110.588 -176.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.422 ' HE3' ' CG ' ' A' ' 117' ' ' LYS . 32.7 mtm -129.44 43.68 3.1 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.388 -1.278 . . . . 1.0800000000000001 107.61 178.034 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.619 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 14.1 mp0 -61.35 -7.14 2.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.877 -1.056 . . . . 1.1499999999999999 113.199 -172.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.616 HG23 HD21 ' A' ' 122' ' ' LEU . 17.9 m -62.94 -28.53 45.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 O-C-N 121.916 -0.49 . . . . 1.1899999999999999 111.187 173.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.755 HD12 ' HD2' ' A' ' 125' ' ' ARG . 3.4 mm? -69.36 -28.08 65.89 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 110.267 -0.271 . . . . 1.0600000000000001 110.267 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.656 HG23 ' SG ' ' A' ' 111' ' ' CYS . 54.7 t -43.04 -53.91 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 O-C-N 123.955 0.784 . . . . 1.0 112.124 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.591 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 3.3 t -75.1 -34.89 61.78 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.877 0.37 . . . . 1.6599999999999999 110.662 -178.484 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.755 ' HD2' HD12 ' A' ' 122' ' ' LEU . 93.0 mtt180 -64.22 -50.28 68.63 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.081 -0.509 . . . . 3.2999999999999998 110.803 -177.043 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.555 HD12 ' HB3' ' A' ' 110' ' ' LEU . 75.8 mt -55.12 -50.03 67.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.675 -0.693 . . . . 1.0600000000000001 110.614 179.361 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.597 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -56.7 -34.2 67.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.408 -0.36 . . . . 1.1000000000000001 111.639 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.821 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -59.41 -61.93 2.26 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.36 0.6 . . . . 1.1200000000000001 110.448 175.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -62.17 -31.87 72.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.853 -1.067 . . . . 4.7699999999999996 111.258 -177.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.866 ' HE1' ' HA ' ' A' ' 104' ' ' PHE . 7.5 mmm -61.91 -59.83 4.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.212 -0.449 . . . . 1.0900000000000001 111.683 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -64.01 -36.32 83.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.429 -0.35 . . . . 1.05 110.78 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.436 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 52.1 m -66.9 -39.21 87.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.416 -0.356 . . . . 1.1299999999999999 111.127 177.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.539 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 55.4 t80 -60.31 -43.16 96.6 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.801 -0.444 . . . . 3.3500000000000001 109.801 175.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.495 HD11 ' HB2' ' A' ' 5' ' ' ASN . 5.7 tt -60.34 -50.27 74.29 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.745 -0.835 . . . . 1.5900000000000001 108.745 174.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . 0.639 ' HB3' ' HE3' ' A' ' 1' ' ' MET . 3.8 m-80 -48.98 -58.31 5.1 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.932 -0.576 . . . . 0.46000000000000002 112.443 178.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -80.23 -45.03 18.7 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 0.58999999999999997 112.054 -172.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . 0.539 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 8.2 m80 -91.97 -50.55 5.65 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.361 0.874 . . . . 2.3399999999999999 113.361 -171.155 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.54 HD23 ' NH2' ' A' ' 99' ' ' ARG . 58.8 mt -91.75 -34.96 14.41 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.607 0.966 . . . . 1.8999999999999999 113.607 -165.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.627 ' HA ' HD12 ' A' ' 142' ' ' ILE . 31.7 tt0 -51.38 -49.84 79.75 Favored Pre-proline 0 C--N 1.324 -0.526 0 O-C-N 123.313 0.383 . . . . 0.75 111.657 -174.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.54 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 52.8 Cg_exo -52.87 -51.31 11.39 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 121.772 1.648 . . . . 0.87 111.624 175.316 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -54.5 -54.22 43.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.45 -0.795 . . . . 1.4299999999999999 110.544 178.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.627 HD12 ' HA ' ' A' ' 139' ' ' GLU . 13.6 mt -42.84 -51.84 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.406 -0.815 . . . . 1.1299999999999999 111.961 175.262 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.609 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 14.8 mm-40 -67.07 -30.01 69.94 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.934 -0.576 . . . . 0.57999999999999996 111.747 -176.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.54 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.0 mm-40 -68.28 -22.28 64.75 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.498 0.666 . . . . 0.78000000000000003 110.7 175.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.636 ' N ' HD21 ' A' ' 145' ' ' ASN . 0.7 OUTLIER -101.72 3.84 40.03 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.28 -0.873 . . . . 0.93000000000000005 108.974 -174.767 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 125.48 -34.02 3.45 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.696 -1.138 . . . . 0.56000000000000005 113.135 173.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 111.7 162.92 17.18 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 111.1 -0.8 . . . . 0.48999999999999999 111.1 -174.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.566 ' HB3' ' CG2' ' A' ' 46' ' ' VAL . 39.9 m95 -58.21 -33.59 69.48 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.124 0.787 . . . . 4.5199999999999996 113.124 -172.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.503 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 29.8 m-20 -56.56 -42.87 79.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.852 0.358 . . . . 1.96 110.082 176.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' THR . . . . . 0.523 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 25.1 m -60.59 -36.48 78.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.733 -0.667 . . . . 1.24 111.721 179.064 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . 0.674 ' CE2' ' HA ' ' A' ' 97' ' ' TRP . 2.2 m-85 -62.81 -39.68 95.04 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.184 0.516 . . . . 3.7200000000000002 109.641 -177.714 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.61 ' HB ' ' HB1' ' A' ' 49' ' ' ALA . 1.4 m -75.5 -24.44 17.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.859 -0.61 . . . . 1.8600000000000001 110.053 176.114 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 12.8 mm-40 -60.88 -23.46 65.2 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 121.672 -0.642 . . . . 1.6699999999999999 110.478 173.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.6 mt -96.23 -56.04 2.76 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.886 -0.597 . . . . 1.96 110.101 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . 0.662 ' OH ' ' HB3' ' A' ' 151' ' ' PHE . 12.0 p90 -121.55 26.51 8.75 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.289 0.566 . . . . 4.3899999999999997 112.49 -173.161 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.743 ' HA2' ' HB1' ' A' ' 49' ' ' ALA . . . -61.48 161.4 26.68 Favored Glycine 0 C--N 1.305 -1.185 0 CA-C-N 115.165 -0.925 . . . . 1.1000000000000001 113.442 -178.003 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.547 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 26.0 t-20 -52.65 109.03 0.36 Allowed 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 114.011 -1.094 . . . . 1.29 111.299 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.679 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 0.6 OUTLIER -98.63 -7.1 28.57 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.755 -0.461 . . . . 3.4399999999999999 109.755 179.243 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -51.6 -35.51 41.82 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.804 -0.635 . . . . 2.6699999999999999 110.88 176.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -97.66 -35.08 10.69 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.029 -0.532 . . . . 2.8700000000000001 110.689 173.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 0.679 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -57.24 -66.43 0.46 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.914 -0.585 . . . . 3.2000000000000002 112.068 -175.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . 0.59 ' HA ' ' HB3' ' A' ' 165' ' ' LYS . 6.6 pt-20 -66.65 -23.77 66.2 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 121.069 -0.252 . . . . 3.7200000000000002 111.266 -179.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 22.6 t -65.18 -42.29 93.78 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.607 -0.516 . . . . 4.2000000000000002 109.607 178.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 168' ' ' GLU . 29.8 mmt180 -79.42 -33.57 42.49 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-O 121.444 0.64 . . . . 6.3700000000000001 110.285 176.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . 0.59 ' HB3' ' HA ' ' A' ' 162' ' ' GLU . 16.4 ttpp -56.24 -44.77 79.95 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.043 -0.981 . . . . 5.0099999999999998 110.952 177.172 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -63.28 -29.12 73.53 Favored Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.645 -0.788 . . . . 5.0999999999999996 113.02 -175.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -89.97 -12.91 37.33 Favored 'General case' 0 C--N 1.329 -0.326 0 O-C-N 122.464 -0.433 . . . . 5.9400000000000004 111.24 178.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 164' ' ' ARG . 44.2 mt-10 -71.33 -17.97 62.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.13 0.49 . . . . 5.8799999999999999 109.976 172.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.52 ' O ' ' HD3' ' A' ' 169' ' ' ARG . 3.6 tmt_? -70.78 -33.44 70.76 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.529 -0.915 . . . . 7.7999999999999998 108.529 177.206 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -105.77 27.19 8.72 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.346 -0.843 . . . . 7.29 109.993 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -66.07 94.89 0.26 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.5 -0.773 . . . . 6.9699999999999998 110.066 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -137.51 16.74 2.93 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.476 0.655 . . . . 9.8100000000000005 109.693 -177.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -135.08 -58.13 0.8 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.442 -0.799 . . . . 11.99 109.511 178.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 62.8 22.2 13.25 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.017 -0.992 . . . . 11.949999999999999 111.553 178.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -80.15 -30.55 38.93 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.326 -0.62 . . . . 14.949999999999999 109.326 175.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -69.41 90.23 0.52 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.647 -0.706 . . . . 15.880000000000001 109.486 177.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -75.53 100.34 4.52 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.061 -0.518 . . . . 16.02 110.69 -177.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 51.6 tp -78.14 -65.52 0.97 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.124 -0.695 . . . . 18.210000000000001 109.124 175.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -177.78 172.02 1.76 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.28 -0.873 . . . . 19.219999999999999 108.8 177.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 18.2 p80 -99.73 150.55 22.19 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.401 -0.52 . . . . 22.800000000000001 109.881 178.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 45.0 m-70 -83.23 171.95 13.09 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.65 -0.5 . . . . 22.510000000000002 109.65 178.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 11.1 p80 -120.64 85.04 2.32 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.593 0.711 . . . . 25.300000000000001 110.867 -178.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . 0.443 ' C ' ' H ' ' A' ' 185' ' ' HIS . 87.3 m-70 -93.5 -29.24 15.63 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.687 -0.688 . . . . 25.77 110.634 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.436 ' HB2' ' O ' ' A' ' 183' ' ' HIS . 50.0 m-70 73.75 -30.48 0.21 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.521 0.728 . . . . 27.370000000000001 112.089 -178.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . 0.443 ' H ' ' C ' ' A' ' 183' ' ' HIS . 68.0 m80 . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.299 -0.857 . . . . 29.52 110.95 179.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.28 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B 1002 ' ' GLY . . . . . 0.484 ' O ' ' H1 ' ' B' 1100 ' ' 33B . . . -116.84 5.93 18.18 Favored Glycine 0 N--CA 1.448 -0.553 0 O-C-N 121.596 -0.69 . . . . 2.9900000000000002 112.12 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.549 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . 24.3 m -128.3 -136.84 0.23 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.637 0.256 . . . . 1.9399999999999999 110.586 -178.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 1.035 HG21 ' H ' ' B' 1005 ' ' GLY . 4.2 m 43.98 -98.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.218 -0.572 0 CA-C-O 117.281 -1.343 . . . . 1.9399999999999999 111.571 -178.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 1.041 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . -39.34 -25.88 0.06 OUTLIER Glycine 0 CA--C 1.535 1.302 0 CA-C-N 120.188 1.358 . . . . 1.26 114.984 167.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 1006 ' ' ARG . . . . . 0.442 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 8.2 mpt_? -85.77 -33.83 21.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 117.635 0.717 . . . . 3.4500000000000002 111.636 175.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 1007 ' ' ALA . . . . . 0.512 ' HB1' ' O2 ' ' B' 1100 ' ' 33B . . . -95.15 -55.58 3.02 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.527 0.566 . . . . 1.54 112.527 -167.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.662 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 2.9 mm? -65.89 -44.26 85.8 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.705 -0.48 . . . . 1.8999999999999999 109.705 -175.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 0.945 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -42.93 -44.5 4.61 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 122.474 1.13 . . . . 1.45 110.502 172.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.86 ' HB2' ' C13' ' B' 1100 ' ' 33B . . . -79.92 -51.16 9.45 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 113.467 -1.697 . . . . 1.51 111.204 -175.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 1011 ' ' PHE . . . . . 0.521 ' HE2' ' H8 ' ' B' 1100 ' ' 33B . 42.6 m-85 -66.61 -19.84 65.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.152 -0.476 . . . . 2.0699999999999998 110.913 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 1012 ' ' GLY . . . . . 0.891 ' HA2' ' HZ ' ' A' ' 57' ' ' PHE . . . -82.23 -2.6 90.62 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 116.006 -0.543 . . . . 0.80000000000000004 113.033 -178.046 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 39.0 t70 -88.6 7.1 35.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.539 0.685 . . . . 1.8999999999999999 109.933 170.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 2.7 m -113.71 91.29 3.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.949 -0.568 . . . . 1.4399999999999999 110.158 178.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.477 HD11 ' O ' ' B' 1012 ' ' GLY . 0.8 OUTLIER -132.17 -97.83 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.155 0.502 . . . . 3.4300000000000002 109.965 179.268 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B 1016 ' ' ASN . . . . . 0.449 ' H ' ' HB ' ' B' 1015 ' ' ILE . 54.9 t30 -135.16 105.66 6.42 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.242 -0.651 . . . . 4.79 109.242 177.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 1017 ' ' ARG . . . . . 0.545 ' HG3' ' HN1' ' B' 1018 ' ' NH2 . 10.1 ptm180 -98.49 -72.58 0.65 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.735 -0.666 . . . . 8.9800000000000004 111.154 -174.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . 0.545 ' HN1' ' HG3' ' B' 1017 ' ' ARG . . . . . . . . 0 C--N 1.323 -0.57 0 O-C-N 122.271 -0.268 . . . . 5.5700000000000003 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.86 ' C13' ' HB2' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.8 tpt . . . . . 0 N--CA 1.484 1.24 0 CA-C-O 120.83 0.348 . . . . 6.4500000000000002 110.653 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.9 m -160.67 -51.06 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.001 -0.545 . . . . 2.2599999999999998 110.585 -179.885 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -72.54 -10.26 59.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.364 -0.38 . . . . 2.7599999999999998 111.091 179.916 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.2 p -63.96 -37.19 86.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.477 -0.329 . . . . 1.54 111.137 -179.791 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.59 ' HA ' HD11 ' A' ' 8' ' ' LEU . 23.9 p30 -64.65 -17.11 63.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.684 0.278 . . . . 1.78 110.869 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.52 ' NH1' ' HA ' ' A' ' 128' ' ' ALA . 9.9 tpp180 -60.22 -39.7 87.56 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.056 0.455 . . . . 1.8999999999999999 109.85 178.999 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -64.41 -42.54 96.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.625 -0.716 . . . . 0.68000000000000005 110.423 179.579 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.59 HD11 ' HA ' ' A' ' 5' ' ' ASN . 8.9 mp -54.36 -39.56 67.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.812 -0.631 . . . . 1.8 110.401 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.449 HG11 ' HB2' ' A' ' 130' ' ' MET . 91.6 t -73.37 -64.8 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.927 -0.579 . . . . 1.0700000000000001 110.086 178.98 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 52.4 t -44.8 -66.77 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.254 -0.884 . . . . 1.1299999999999999 112.178 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -43.32 -33.58 1.03 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.58999999999999997 112.137 -179.226 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.432 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.2 t80 -77.33 -46.68 22.15 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.107 -0.237 . . . . 2.02 111.221 -179.556 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.63 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 10.0 mp -60.45 -37.51 81.2 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.948 0.404 . . . . 1.0600000000000001 110.525 179.536 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.432 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 38.3 t -68.13 -42.51 80.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.873 -0.603 . . . . 1.6000000000000001 110.195 179.635 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -68.9 -24.28 64.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.713 -0.676 . . . . 1.49 110.442 179.596 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.492 ' HG3' HG23 ' A' ' 112' ' ' VAL . 1.9 tppt? -85.34 -16.52 39.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.942 -0.572 . . . . 1.8400000000000001 110.775 -179.761 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 mp -90.04 -13.92 34.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.072 -0.513 . . . . 1.98 110.116 179.263 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 72.6 m -75.27 -35.88 61.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.788 -0.642 . . . . 1.3799999999999999 110.728 179.702 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -70.55 -4.84 25.04 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.318 -0.401 . . . . 1.51 110.473 179.769 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.414 ' HG3' HG13 ' A' ' 112' ' ' VAL . 29.7 mmmt -109.51 -26.04 10.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.849 -0.614 . . . . 2.6499999999999999 110.775 -179.845 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.03 4.29 44.88 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.841 -0.695 . . . . 0.54000000000000004 111.98 -179.402 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -102.1 160.9 14.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.854 0.359 . . . . 1.1200000000000001 110.855 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.1 t -110.79 138.73 46.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.063 -0.517 . . . . 0.75 110.573 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.432 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 11.6 t90 -68.01 -45.36 74.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.066 -0.516 . . . . 4.29 111.085 -179.934 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.445 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 50.9 m -56.96 -41.68 78.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 1.8600000000000001 111.834 -179.369 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -56.59 -24.02 44.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.298 -0.41 . . . . 1.52 112.044 -179.227 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -126.7 16.0 7.52 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.878 0.325 . . . . 1.53 111.878 -179.08 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.532 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 83.6 p -99.9 -179.99 4.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.12 0.486 . . . . 2.04 111.413 -179.792 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.456 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 9.7 t70 -166.07 -15.34 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.394 -0.821 . . . . 2.3100000000000001 109.868 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.688 HG21 ' H ' ' A' ' 31' ' ' GLU . 0.6 OUTLIER -58.58 -75.99 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.319 -0.855 . . . . 1.4099999999999999 111.809 -179.833 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.688 ' H ' HG21 ' A' ' 30' ' ' VAL . 42.8 mt-10 -87.5 -3.43 59.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.927 0.394 . . . . 2.7400000000000002 110.682 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.456 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 38.7 tt0 -67.96 -46.63 70.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 1.45 111.367 -179.627 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -93.39 -57.95 2.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.315 -0.402 . . . . 1.8700000000000001 111.553 -179.432 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 18.0 ptt180 -100.42 156.37 17.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.919 0.39 . . . . 3.8199999999999998 111.283 -179.691 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 68.0 p -118.63 93.28 4.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.87 -0.605 . . . . 2.6699999999999999 110.737 179.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -74.08 -85.64 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.949 -0.569 . . . . 3.3399999999999999 111.47 -179.629 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -88.01 158.52 49.94 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.805 -0.634 . . . . 2.4399999999999999 111.319 -179.358 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.497 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 39.1 Cg_exo -61.14 -176.15 0.15 Allowed 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.335 2.023 . . . . 1.8700000000000001 111.846 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -75.52 -18.44 59.8 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.05 -0.523 . . . . 4.6399999999999997 110.978 -179.971 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 170.06 55.13 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.474 -0.87 . . . . 2.3999999999999999 113.024 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.529 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.7 OUTLIER -56.62 -59.17 5.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.95 0.405 . . . . 1.45 110.491 179.273 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.529 ' H ' HG23 ' A' ' 41' ' ' THR . 12.2 pt-20 -124.07 -19.6 5.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.423 0.63 . . . . 2.02 109.377 179.084 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.539 ' HA ' HG22 ' A' ' 46' ' ' VAL . 27.1 m -72.77 -23.34 60.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.918 -1.037 . . . . 1.25 112.409 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -52.28 -36.36 52.59 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.094 0.405 . . . . 1.9099999999999999 112.094 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -91.81 -36.17 13.68 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.172 0.434 . . . . 1.1799999999999999 112.172 -179.024 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.539 HG22 ' HA ' ' A' ' 43' ' ' SER . 1.5 m -75.27 -28.12 20.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 111.876 0.324 . . . . 2.0099999999999998 111.876 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.6 ptmt -77.94 -34.21 51.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.887 0.375 . . . . 1.3799999999999999 110.121 -179.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.468 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 11.0 mm100 -68.61 -36.32 78.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.861 -0.609 . . . . 0.98999999999999999 109.423 178.745 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.418 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -77.59 -31.7 53.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.532 -0.758 . . . . 1.1399999999999999 109.47 178.544 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 46' ' ' VAL . 28.9 tp -67.41 -31.65 72.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.972 -1.013 . . . . 1.95 110.082 179.39 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -70.06 -40.45 75.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.263 -0.881 . . . . 2.5099999999999998 110.543 179.6 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.9 -45.97 69.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.927 -0.579 . . . . 1.1000000000000001 110.707 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.99 -36.54 83.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 1.04 110.925 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.44 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -72.0 -37.88 60.14 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.811 -0.709 . . . . 0.69999999999999996 112.395 -179.985 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -55.35 -43.81 75.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.69 0.281 . . . . 1.04 111.386 -179.798 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -72.65 -16.68 61.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.335 -0.393 . . . . 2.29 111.49 -179.602 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -90.33 -31.46 16.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.578 -0.283 . . . . 2.9300000000000002 111.26 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 49.2 mt-10 -63.84 -60.79 2.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.428 -0.351 . . . . 1.3 111.549 -179.523 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.449 HD12 ' N ' ' A' ' 60' ' ' ARG . 3.8 pp -54.97 -20.42 9.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.055 -0.521 . . . . 2.1899999999999999 111.758 -179.347 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.449 ' N ' HD12 ' A' ' 59' ' ' LEU . 23.4 ttm180 -66.66 -38.5 86.97 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.2 0.445 . . . . 3.1400000000000001 112.2 -178.818 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -129.63 15.15 5.97 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.133 -0.227 . . . . 5.5899999999999999 111.449 -179.389 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -50.49 -47.0 57.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.501 -0.318 . . . . 4.9299999999999997 111.642 -179.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -32.33 54.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.171 -0.468 . . . . 5.3499999999999996 111.61 -179.2 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.22 -26.51 18.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.909 0.385 . . . . 1.7 111.083 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.405 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -58.31 -39.25 78.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.944 -0.571 . . . . 3.52 111.635 -179.33 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 69.6 m -76.5 -25.7 54.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.798 0.332 . . . . 2.5899999999999999 111.16 -179.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -93.7 -12.33 29.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.155 -0.475 . . . . 2.7200000000000002 111.045 -179.463 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.2 mp -80.91 -9.04 59.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 2.25 111.143 -179.491 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 46.0 p -59.8 -31.03 69.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 1.26 110.874 179.765 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -77.01 -36.88 55.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.962 -0.563 . . . . 1.8 110.74 179.842 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -74.53 -23.62 58.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 1.8899999999999999 110.534 179.78 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 44.7 mt -92.87 -18.22 23.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.811 -0.632 . . . . 1.98 110.989 -179.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 m80 55.69 49.46 16.3 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 110.117 -0.327 . . . . 3.54 110.117 -179.081 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.524 HG13 ' HB3' ' A' ' 113' ' ' GLU . 37.8 mm -49.56 93.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.991 -0.549 . . . . 1.1499999999999999 110.968 -179.755 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.495 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.4 OUTLIER -130.94 164.6 40.96 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 115.478 -0.783 . . . . 1.1200000000000001 110.028 -179.368 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.53 ' HA ' HD23 ' A' ' 122' ' ' LEU . 12.4 Cg_endo -55.62 142.07 82.58 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.191 1.928 . . . . 0.53000000000000003 113.61 -179.234 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.61 ' H ' HD13 ' A' ' 122' ' ' LEU . . . 63.92 -77.56 0.05 OUTLIER Glycine 0 CA--C 1.52 0.401 0 CA-C-N 115.464 -0.789 . . . . 0.40999999999999998 114.828 178.17 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.415 HG23 ' NE2' ' A' ' 81' ' ' GLN . 58.9 p -55.05 -4.83 0.08 Allowed 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 113.652 0.982 . . . . 1.22 113.652 -177.931 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 75' ' ' THR . . . -60.11 -24.8 64.95 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 121.483 0.659 . . . . 1.0700000000000001 109.233 178.447 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -69.1 -32.83 72.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.83 -1.077 . . . . 4.3099999999999996 110.091 179.242 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.415 ' NE2' HG23 ' A' ' 78' ' ' THR . 46.9 mt-30 -72.48 -25.47 61.44 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.269 0.557 . . . . 1.03 109.623 178.532 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.3 m -75.73 -40.44 55.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.442 -0.799 . . . . 0.47999999999999998 108.9 178.548 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -74.89 -14.59 60.68 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.921 -1.036 . . . . 1.4399999999999999 109.044 178.505 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.508 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.4 tt0 -67.77 -42.3 81.92 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.28 -0.873 . . . . 0.80000000000000004 110.39 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -60.36 -25.62 65.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.034 -0.53 . . . . 1.99 110.618 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.403 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 41.4 t -87.31 -50.09 14.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.833 -0.621 . . . . 1.8999999999999999 111.401 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.508 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.2 p -63.69 -26.85 41.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.444 -0.344 . . . . 1.4299999999999999 111.107 -179.719 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -67.14 -39.14 86.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.987 0.422 . . . . 0.91000000000000003 110.535 179.632 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.666 ' HA ' ' HD2' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -89.93 -4.18 57.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.884 -0.598 . . . . 2.8700000000000001 110.532 179.571 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.612 HD12 HH11 ' A' ' 99' ' ' ARG . 3.7 tp -93.59 9.21 37.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.736 -0.666 . . . . 1.9199999999999999 111.291 -179.295 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.553 ' HA ' HG21 ' A' ' 95' ' ' VAL . 2.8 p90 -144.44 -28.66 0.49 Allowed 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.692 -0.403 . . . . 2.9700000000000002 111.937 -179.992 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.666 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -77.8 -22.88 49.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.73 0.3 . . . . 5.6699999999999999 110.971 -179.514 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.419 ' N ' ' HD3' ' A' ' 92' ' ' ARG . 19.9 t70 -88.92 2.49 53.72 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 3.1200000000000001 110.62 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 113.66 109.91 2.91 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.855 -0.688 . . . . 2.3100000000000001 112.389 -179.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.553 HG21 ' HA ' ' A' ' 91' ' ' PHE . 42.2 t -79.16 90.22 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.862 0.363 . . . . 1.6799999999999999 111.01 179.99 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' ASN . . . . . 0.631 HD21 ' N ' ' A' ' 96' ' ' ASN . 0.7 OUTLIER -89.48 178.34 6.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.048 -0.524 . . . . 2.1200000000000001 110.348 179.653 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 22.1 m-90 -60.55 -60.57 3.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.032 0.444 . . . . 4.1200000000000001 110.146 179.121 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.531 ' HA3' ' HB ' ' B' 1015 ' ' ILE . . . -64.45 -26.19 70.58 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.618 -0.719 . . . . 0.80000000000000004 111.996 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.612 HH11 HD12 ' A' ' 90' ' ' LEU . 13.5 tpp180 -56.06 -36.04 67.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.21 0.528 . . . . 4.9100000000000001 110.162 179.376 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.593 HG23 HD23 ' A' ' 138' ' ' LEU . 37.9 mt -71.99 -37.67 61.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.445 -0.798 . . . . 1.1100000000000001 111.198 -179.775 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.468 HG22 ' O ' ' A' ' 98' ' ' GLY . 1.0 OUTLIER -63.23 -29.8 48.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.03 0.443 . . . . 2.0299999999999998 109.958 179.616 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.19 -28.98 67.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.705 -0.68 . . . . 1.0600000000000001 109.509 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.476 ' HB2' HD23 ' A' ' 90' ' ' LEU . 86.3 t80 -72.06 -22.27 61.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.97 -1.014 . . . . 1.8400000000000001 110.207 179.455 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.437 ' HE2' HG21 ' A' ' 100' ' ' ILE . 72.2 m-85 -90.86 -46.02 8.45 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.773 -0.649 . . . . 4.21 111.201 179.765 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.432 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 19.7 p -62.01 -40.65 96.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.937 -0.574 . . . . 1.55 110.665 -179.954 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 15.9 t80 -80.25 -41.91 24.19 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.18 -0.463 . . . . 3.6400000000000001 110.591 179.864 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.91 -43.76 98.95 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.451 -0.88 . . . . 0.32000000000000001 111.12 178.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.63 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -70.67 -28.65 70.57 Favored Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 110.591 -1.004 . . . . 0.23999999999999999 110.591 178.449 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.405 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -70.55 -30.84 67.67 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.256 -0.646 . . . . 1.05 109.256 178.338 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.458 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -65.3 -33.74 76.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.446 -0.797 . . . . 1.78 108.896 178.851 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.463 ' SG ' HG23 ' A' ' 123' ' ' VAL . 3.2 t -68.12 -38.49 82.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.184 -0.916 . . . . 0.90000000000000002 109.955 178.906 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.492 HG23 ' HG3' ' A' ' 16' ' ' LYS . 74.7 t -70.1 -39.23 76.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.725 -0.67 . . . . 1.2 110.534 179.339 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.524 ' HB3' HG13 ' A' ' 74' ' ' ILE . 31.0 mt-10 -67.65 -21.15 65.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.038 -0.528 . . . . 2.5099999999999998 109.948 179.454 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.451 ' HB3' ' HB2' ' A' ' 122' ' ' LEU . 74.9 m -77.23 -50.16 13.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.677 -0.692 . . . . 0.28000000000000003 109.867 179.07 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.401 HG11 ' HA ' ' A' ' 112' ' ' VAL . 3.4 p -66.65 -21.82 29.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.059 -0.519 . . . . 1.8300000000000001 109.983 179.001 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -63.63 -37.85 88.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.64 -0.709 . . . . 0.59999999999999998 110.492 179.477 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -93.69 22.29 5.64 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.992 -0.549 . . . . 2.1600000000000001 110.716 179.898 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 67.77 22.32 8.9 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.205 -0.452 . . . . 1.8799999999999999 110.936 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.483 ' SD ' ' HD3' ' A' ' 76' ' ' PRO . 10.4 mtm -114.77 78.01 1.12 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.251 -0.431 . . . . 1.0800000000000001 110.506 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 13.9 mp0 -84.59 -3.5 58.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.474 -0.33 . . . . 1.1499999999999999 111.668 -179.219 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.571 HG23 HD22 ' A' ' 122' ' ' LEU . 25.4 m -72.61 -5.91 7.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.855 0.36 . . . . 1.1899999999999999 110.914 179.87 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.61 HD13 ' H ' ' A' ' 77' ' ' GLY . 4.1 mm? -93.09 -16.87 24.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.043 -0.526 . . . . 1.0600000000000001 110.063 179.123 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.463 HG23 ' SG ' ' A' ' 111' ' ' CYS . 94.3 t -52.72 -59.08 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.786 -0.643 . . . . 1.0 111.074 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 124' ' ' SER . . . . . 0.532 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 37.5 t -65.83 -36.76 84.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.032 -0.531 . . . . 1.6599999999999999 111.449 -179.692 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . 0.602 ' HD2' HD11 ' A' ' 122' ' ' LEU . 94.4 mtt180 -60.74 -67.12 0.43 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.507 -0.315 . . . . 3.2999999999999998 111.248 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 126' ' ' ILE . . . . . 0.458 HD13 ' HB3' ' A' ' 110' ' ' LEU . 74.6 mt -44.82 -42.68 2.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.044 -0.525 . . . . 1.0600000000000001 111.489 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.498 ' HB1' HD22 ' A' ' 13' ' ' LEU . . . -56.62 -42.52 78.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.416 -0.357 . . . . 1.1000000000000001 111.057 179.855 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.52 ' HA ' ' NH1' ' A' ' 6' ' ' ARG . . . -69.13 -41.47 77.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.031 -0.531 . . . . 1.1200000000000001 111.376 -179.963 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -64.31 -39.36 93.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.325 -0.398 . . . . 4.7699999999999996 111.32 -179.778 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.449 ' HB2' HG11 ' A' ' 9' ' ' VAL . 89.2 mtp -65.16 -52.83 52.65 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.19 -0.459 . . . . 1.0900000000000001 111.083 -179.574 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -57.8 -53.91 52.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.277 -0.419 . . . . 1.05 110.749 179.788 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.8 m -54.22 -49.73 68.76 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.052 -0.522 . . . . 1.1299999999999999 111.066 179.869 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -57.03 -30.78 64.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.151 0.5 . . . . 3.3500000000000001 110.052 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . 0.411 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 3.6 tt -81.28 -23.2 38.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.55 -0.75 . . . . 1.5900000000000001 110.119 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -83.06 -6.91 59.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 0.46000000000000002 112.06 -179.525 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -126.99 -30.47 2.71 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.126 0.787 . . . . 0.58999999999999997 113.126 -178.148 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 8.3 m80 -107.54 -52.36 2.77 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.29 0.848 . . . . 2.3399999999999999 113.29 -178.124 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.593 HD23 HG23 ' A' ' 100' ' ' ILE . 10.1 mp -80.84 -37.24 30.33 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.858 1.059 . . . . 1.8999999999999999 113.858 -177.102 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.436 ' N ' ' HD2' ' A' ' 140' ' ' PRO . 34.8 tt0 -48.73 -53.84 32.88 Favored Pre-proline 0 N--CA 1.468 0.453 0 N-CA-C 112.407 0.521 . . . . 0.75 112.407 -178.073 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . 0.442 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 37.2 Cg_endo -65.6 -28.58 52.81 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.733 1.622 . . . . 0.87 112.272 -179.623 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . 0.431 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 1.2 t-105 -78.57 -30.01 46.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 1.4299999999999999 111.155 -179.612 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 142' ' ' ILE . . . . . 0.667 HG21 ' HA2' ' A' ' 147' ' ' GLY . 60.5 mt -69.83 -40.22 78.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.969 -0.559 . . . . 1.1299999999999999 110.656 -179.706 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 79.0 mm-40 -63.08 -28.68 70.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.519 . . . . 0.57999999999999996 110.114 179.322 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 16.5 mm-40 -69.62 -23.8 63.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.847 -0.615 . . . . 0.78000000000000003 110.235 179.301 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 145' ' ' ASN . . . . . 0.561 HD21 ' N ' ' A' ' 145' ' ' ASN . 0.8 OUTLIER -97.51 -1.37 44.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.712 -0.676 . . . . 0.93000000000000005 110.718 -179.994 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.14 -35.91 3.61 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.869 -0.682 . . . . 0.56000000000000005 112.812 179.758 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . 0.667 ' HA2' HG21 ' A' ' 142' ' ' ILE . . . 117.15 167.31 14.39 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.806 -0.711 . . . . 0.48999999999999999 112.155 -179.741 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 148' ' ' TRP . . . . . 0.552 ' NE1' HD12 ' A' ' 142' ' ' ILE . 10.7 m-90 -57.76 -38.24 75.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.061 0.458 . . . . 4.5199999999999996 110.176 179.459 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.424 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 32.5 t70 -60.34 -27.38 67.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.634 -0.712 . . . . 1.96 110.449 179.867 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 25.2 m -83.37 -25.38 31.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.273 0.558 . . . . 1.24 109.912 178.996 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -68.48 -35.2 77.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.481 -0.781 . . . . 3.7200000000000002 110.383 179.547 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 152' ' ' VAL . . . . . 0.509 HG22 ' HA2' ' A' ' 156' ' ' GLY . 12.2 p -78.79 -2.17 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.436 0.636 . . . . 1.8600000000000001 110.114 179.265 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 15.8 mm-40 -91.69 -18.02 24.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.809 -0.632 . . . . 1.6699999999999999 109.7 178.657 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 22.7 mt -106.58 -52.88 2.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.488 -0.778 . . . . 1.96 110.393 179.714 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -109.0 27.82 9.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.577 -0.738 . . . . 4.3899999999999997 110.943 -179.824 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 156' ' ' GLY . . . . . 0.509 ' HA2' HG22 ' A' ' 152' ' ' VAL . . . -46.78 152.46 1.32 Allowed Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.909 -0.587 . . . . 1.1000000000000001 113.683 -179.324 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 157' ' ' ASN . . . . . 0.468 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 21.5 t-20 -60.69 116.72 4.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.624 -0.288 . . . . 1.29 110.661 179.719 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 158' ' ' ASN . . . . . 0.524 ' HA ' ' HB1' ' A' ' 161' ' ' ALA . 8.8 m120 -69.99 -24.82 63.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.334 -0.394 . . . . 3.4399999999999999 111.701 -179.629 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.86 -26.06 65.54 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.014 0.435 . . . . 2.6699999999999999 110.295 179.474 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -105.05 -34.16 8.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.757 -0.656 . . . . 2.8700000000000001 110.396 179.297 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 161' ' ' ALA . . . . . 0.524 ' HB1' ' HA ' ' A' ' 158' ' ' ASN . . . -61.17 -44.18 97.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.998 -0.546 . . . . 3.2000000000000002 110.022 179.239 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -69.6 -34.73 74.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.569 -0.742 . . . . 3.7200000000000002 109.659 178.966 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 46.8 t -59.82 -40.25 87.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.836 -0.62 . . . . 4.2000000000000002 109.486 178.967 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 164' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 168' ' ' GLU . 8.1 mpt_? -77.57 -30.97 52.88 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.566 -0.743 . . . . 6.3700000000000001 109.683 178.697 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -70.24 -27.9 64.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.636 -0.711 . . . . 5.0099999999999998 109.874 179.39 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 166' ' ' GLY . . . . . 0.476 ' O ' ' HB2' ' A' ' 169' ' ' ARG . . . -64.48 -53.99 32.1 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.573 -0.74 . . . . 5.0999999999999996 111.5 179.568 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -63.33 -17.79 62.94 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.047 -0.723 . . . . 5.9400000000000004 109.047 178.597 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . 0.489 ' HG2' ' HA ' ' A' ' 173' ' ' HIS . 39.4 mt-10 -88.82 42.34 1.07 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.173 -0.921 . . . . 5.8799999999999999 109.938 178.861 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.476 ' HB2' ' O ' ' A' ' 166' ' ' GLY . 0.0 OUTLIER -127.73 -70.59 0.69 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.403 -0.817 . . . . 7.7999999999999998 109.727 179.105 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.553 ' C ' ' H ' ' A' ' 172' ' ' HIS . 3.2 mm? -66.79 -61.31 2.02 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 109.226 -0.657 . . . . 7.29 109.226 178.959 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.45 -0.56 2.8 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 107.89 -1.152 . . . . 6.9699999999999998 107.89 177.495 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 172' ' ' HIS . . . . . 0.553 ' H ' ' C ' ' A' ' 170' ' ' LEU . 0.4 OUTLIER 76.81 -62.84 0.4 Allowed 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 114.323 -1.308 . . . . 9.8100000000000005 110.517 179.384 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 173' ' ' HIS . . . . . 0.804 ' HD1' ' H ' ' A' ' 175' ' ' HIS . 0.6 OUTLIER 162.83 -153.13 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.477 -1.305 . . . . 11.99 107.477 179.598 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 174' ' ' HIS . . . . . 0.592 ' HD1' ' HE2' ' A' ' 177' ' ' HIS . 0.3 OUTLIER -48.46 -16.64 0.11 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.266 -0.642 . . . . 11.949999999999999 109.266 178.351 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 175' ' ' HIS . . . . . 0.804 ' H ' ' HD1' ' A' ' 173' ' ' HIS . 0.0 OUTLIER -38.25 -27.26 0.02 OUTLIER 'General case' 0 C--O 1.212 -0.875 0 CA-C-N 115.256 -0.884 . . . . 14.949999999999999 111.598 178.525 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 176' ' ' HIS . . . . . 0.628 ' ND1' ' N ' ' A' ' 177' ' ' HIS . 15.0 p80 -35.79 -41.01 0.2 Allowed 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.914 -0.773 . . . . 15.880000000000001 108.914 179.157 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 177' ' ' HIS . . . . . 0.628 ' N ' ' ND1' ' A' ' 176' ' ' HIS . 0.1 OUTLIER -81.61 45.2 0.86 Allowed 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 107.53 -1.285 . . . . 16.02 107.53 177.843 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.624 ' HB3' ' ND1' ' A' ' 183' ' ' HIS . 0.9 OUTLIER 71.94 130.84 0.04 OUTLIER 'General case' 0 N--CA 1.44 -0.952 0 N-CA-C 108.3 -1.0 . . . . 18.210000000000001 108.3 -176.577 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 179' ' ' GLU . . . . . 0.708 ' O ' ' N ' ' A' ' 181' ' ' HIS . 0.3 OUTLIER -13.5 120.3 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.662 0 O-C-N 124.09 0.869 . . . . 19.219999999999999 111.799 -179.064 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 180' ' ' HIS . . . . . 0.625 ' NE2' ' HG3' ' A' ' 179' ' ' GLU . 0.0 OUTLIER 7.09 -59.78 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.461 0 O-C-N 125.224 1.577 . . . . 22.800000000000001 114.028 179.968 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . 0.708 ' N ' ' O ' ' A' ' 179' ' ' GLU . 12.0 m-70 -130.37 -32.76 1.74 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.855 -0.611 . . . . 22.510000000000002 110.256 -179.285 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 182' ' ' HIS . . . . . 0.62 ' HB2' ' HB3' ' A' ' 179' ' ' GLU . 0.7 OUTLIER -61.88 141.76 57.78 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.016 -0.993 . . . . 25.300000000000001 109.447 -179.934 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 183' ' ' HIS . . . . . 0.692 ' NE2' ' HB2' ' A' ' 179' ' ' GLU . 5.8 p80 44.16 14.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 O-C-N 124.064 0.853 . . . . 25.77 110.284 -177.216 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 184' ' ' HIS . . . . . 0.625 ' HD1' ' HA ' ' A' ' 181' ' ' HIS . 8.4 t-80 -116.28 161.14 19.45 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 114.614 -1.175 . . . . 27.370000000000001 108.065 179.818 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . 0.619 ' HE2' ' HB3' ' A' ' 181' ' ' HIS . 1.3 p-80 . . . . . 0 C--O 1.247 0.929 0 O-C-N 124.203 0.939 . . . . 29.52 111.654 179.51 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.092 . . . . . . . . 4.4199999999999999 . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -94.66 2.22 66.92 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.694 -0.765 . . . . 2.9900000000000002 112.625 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1003 ' ' CYS . . . . . 0.519 ' O ' ' N ' ' B' 1005 ' ' GLY . 72.8 m -94.42 -142.91 0.24 Allowed 'General case' 0 C--N 1.328 -0.34 0 O-C-N 122.877 -0.19 . . . . 1.9399999999999999 110.972 -179.829 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B 1004 ' ' VAL . . . . . 0.677 HG21 ' H ' ' B' 1005 ' ' GLY . 1.7 m 43.22 -80.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 123.307 0.643 . . . . 1.9399999999999999 112.298 -179.63 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B 1005 ' ' GLY . . . . . 0.677 ' H ' HG21 ' B' 1004 ' ' VAL . . . -48.6 -23.02 2.98 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 121.002 -0.618 . . . . 1.26 112.858 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -110.11 -40.61 4.67 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.835 0.35 . . . . 3.4500000000000002 111.188 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1007 ' ' ALA . . . . . 0.446 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . . . -56.95 -76.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.008 -0.542 . . . . 1.54 112.22 -179.197 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B 1008 ' ' LEU . . . . . 0.44 ' H ' HD21 ' B' 1008 ' ' LEU . 3.3 mm? -50.99 -35.2 32.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 1.8999999999999999 111.846 -178.875 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B 1009 ' ' ALA . . . . . 0.54 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -62.8 -38.87 92.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.121 0.486 . . . . 1.45 110.977 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B 1010 ' ' ALA . . . . . 0.471 ' HB3' ' H13' ' B' 1100 ' ' 33B . . . -79.95 -52.64 7.59 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.577 -0.738 . . . . 1.51 111.704 -179.306 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -60.31 -25.42 65.76 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.805 0.336 . . . . 2.0699999999999998 110.763 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.88 9.15 12.01 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 121.007 -0.616 . . . . 0.80000000000000004 112.787 -179.829 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 20.7 t70 -105.16 -5.15 20.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.988 0.423 . . . . 1.8999999999999999 110.405 179.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 5.1 m -97.7 -1.14 44.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.862 -0.608 . . . . 1.4399999999999999 111.239 -179.585 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B 1015 ' ' ILE . . . . . 0.531 ' HB ' ' HA3' ' A' ' 98' ' ' GLY . 1.6 pp -64.36 -11.35 10.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 112.209 0.448 . . . . 3.4300000000000002 112.209 -179.399 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B 1016 ' ' ASN . . . . . 0.554 ' HB3' ' NH1' ' B' 1017 ' ' ARG . 6.2 t-20 -59.05 -68.48 0.27 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.675 0.274 . . . . 4.79 110.456 -179.737 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B 1017 ' ' ARG . . . . . 0.554 ' NH1' ' HB3' ' B' 1016 ' ' ASN . 0.0 OUTLIER -177.25 -163.73 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.371 -0.377 . . . . 8.9800000000000004 110.868 179.325 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.664 -0.244 . . . . 5.5700000000000003 . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B 1100 ' ' 33B . . . . . 0.471 ' H13' ' HB3' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 . . . . . 0 N--CA 1.468 0.437 0 N-CA-C 112.137 0.421 . . . . 2.42 112.137 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.2 m -65.17 -18.05 64.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.833 0.349 . . . . 1.25 110.815 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.597 ' HB2' HD13 ' A' ' 134' ' ' LEU . 4.9 p30 -59.0 -27.25 65.25 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.055 -0.521 . . . . 1.78 111.01 173.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.586 ' O ' HG23 ' A' ' 10' ' ' VAL . 8.7 tpp85 -58.93 -47.76 83.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.814 -0.63 . . . . 1.4 110.278 177.842 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -54.46 -47.71 72.6 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 115.316 -0.857 . . . . 0.68 110.867 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.437 HD22 HG22 ' A' ' 46' ' ' VAL . 6.2 mt -57.77 -40.16 79.14 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.5 -1.227 . . . . 1.16 109.814 -173.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.4 t -67.53 -59.68 3.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.552 -0.749 . . . . 0.27 110.196 174.364 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 6' ' ' ARG . 63.4 t -53.6 -50.86 47.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.117 -0.947 . . . . 0.33 112.633 -174.389 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.6 -37.21 70.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.872 0.367 . . . . 0.59 110.876 -176.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.706 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 35.3 t80 -73.6 -47.18 42.31 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 116.297 -0.41 . . . . 1.61 110.793 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.877 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.7 mp -59.13 -38.04 78.67 Favored 'General case' 0 C--O 1.228 -0.075 0 C-N-CA 120.249 -0.58 . . . . 0.34 109.797 178.568 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.448 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 26.3 m -55.27 -50.42 69.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 1.05 110.853 175.658 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -64.62 -32.06 73.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.003 -0.544 . . . . 1.22 110.461 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.625 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 7.6 mmpt? -63.94 -43.99 94.21 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 115.974 -0.557 . . . . 1.41 111.353 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.657 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.4 OUTLIER -71.55 -30.2 65.61 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 120.178 -0.609 . . . . 1.35 110.079 178.633 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.6 t -60.81 -40.23 91.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.638 -0.71 . . . . 0.94 111.24 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -78.91 0.3 27.9 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.959 0.409 . . . . 1.37 112.014 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.652 ' HE2' HG11 ' A' ' 112' ' ' VAL . 19.0 mmmt -111.6 -27.08 8.71 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.899 0.857 . . . . 2.2 109.123 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.79 20.29 11.87 Favored Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 114.097 -1.411 . . . . 0.53 111.663 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -108.18 167.38 10.05 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.37 -0.604 . . . . 0.76 109.37 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.42 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 3.9 t -110.42 144.42 39.24 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 121.084 0.468 . . . . 0.52 110.359 176.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.448 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.8 OUTLIER -74.44 -48.36 28.0 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.53 -0.759 . . . . 3.36 109.787 175.06 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.471 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 2.5 p -66.19 -31.46 72.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.035 -0.53 . . . . 1.37 111.92 -173.296 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.42 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 89.9 mt-30 -61.71 -25.33 67.36 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.259 0.552 . . . . 1.11 111.148 177.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -121.35 17.64 11.42 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.559 -0.746 . . . . 1.28 111.058 -176.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.567 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 54.1 p -100.24 -178.13 3.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.484 0.659 . . . . 1.81 112.415 -171.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.615 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 6.7 t70 -171.97 -23.81 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.378 -1.283 . . . . 2.31 109.069 -178.079 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.831 HG23 ' H ' ' A' ' 31' ' ' GLU . 7.1 m -47.17 -70.83 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 114.274 -1.33 . . . . 0.92 112.643 -174.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.831 ' H ' HG23 ' A' ' 30' ' ' VAL . 8.7 pt-20 -100.6 1.16 40.5 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.53 0.681 . . . . 2.74 109.245 175.945 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.615 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 31.1 tt0 . . . . . 0 N--CA 1.45 -0.455 0 CA-C-N 114.814 -1.085 . . . . 1.45 110.894 -176.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.81 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.8 OUTLIER . . . . . 0 CA--C 1.535 0.372 0 CA-C-O 120.602 0.239 . . . . 1.12 110.488 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.81 ' H ' HG23 ' A' ' 41' ' ' THR . 15.2 pt-20 -93.68 -31.94 14.25 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 122.343 1.068 . . . . 2.02 108.935 170.017 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.952 ' HA ' HG13 ' A' ' 46' ' ' VAL . 66.6 m -59.17 -25.91 64.33 Favored 'General case' 0 C--O 1.209 -1.027 0 CA-C-N 113.315 -1.766 . . . . 1.25 113.496 -170.281 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -43.96 -38.89 3.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 118.131 0.423 . . . . 1.91 111.56 -177.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.409 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -86.06 -42.35 14.02 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.567 0.21 . . . . 0.52 111.567 174.488 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.952 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.6 m -68.33 -41.92 83.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 120.908 -0.317 . . . . 1.41 111.796 -175.343 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.795 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.0 ptpt -68.4 -36.26 78.85 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.154 -0.684 . . . . 0.67 109.154 178.094 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.491 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 24.8 mm-40 -61.16 -36.52 80.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.587 -0.733 . . . . 0.99 111.405 174.064 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.625 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -75.7 -40.66 55.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.673 0.749 . . . . 0.42 110.177 175.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.559 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -56.65 -40.71 75.94 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.722 -1.126 . . . . 1.33 112.113 -178.92 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.544 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 7.5 ptp180 -75.44 -29.89 59.84 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.774 0.797 . . . . 2.17 109.617 -169.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 32.9 mm-40 -72.51 -48.3 41.63 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.283 -1.326 . . . . 1.1 109.852 179.297 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.57 -36.99 85.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.557 -0.747 . . . . 0.53 110.355 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.585 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -61.89 -42.36 99.73 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.912 -0.585 . . . . 0.7 111.782 176.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -58.64 -42.98 89.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.005 0.431 . . . . 1.04 110.517 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -57.41 -28.26 63.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.394 -0.821 . . . . 2.29 111.239 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.496 ' CZ ' HD12 ' B' 1008 ' ' LEU . 17.2 t80 -82.2 -39.4 23.18 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.221 -0.445 . . . . 2.29 110.983 178.452 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.705 ' HA ' ' CE2' ' A' ' 61' ' ' TYR . 40.2 mt-10 -60.52 -63.69 1.21 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.138 -0.483 . . . . 1.3 112.21 -168.821 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.636 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -49.64 -37.46 28.35 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 123.673 0.608 . . . . 1.54 112.342 -178.399 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.636 ' H ' HD12 ' A' ' 59' ' ' LEU . 63.6 mtt180 -63.6 -44.54 93.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.172 -0.467 . . . . 2.58 111.728 -177.425 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.705 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 5.5 p90 -90.95 -7.81 51.03 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 120.654 -0.418 . . . . 5.32 111.506 -179.267 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -58.28 -26.0 62.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 4.48 111.385 -174.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -55.87 -46.26 78.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.046 -0.525 . . . . 4.72 110.937 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.701 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.85 -32.7 15.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.409 -0.36 . . . . 1.17 111.498 -178.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.697 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 47.5 t80 -42.91 -46.92 5.54 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.735 1.013 . . . . 2.81 113.735 -171.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.2 p -68.13 -27.53 66.52 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.92 0.391 . . . . 2.19 111.608 -175.079 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -90.42 -29.21 18.14 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.023 -0.535 . . . . 2.72 111.552 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 65.1 mt -66.48 -17.77 64.99 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.894 0.702 . . . . 1.56 112.894 -171.172 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.641 HG22 HG13 ' A' ' 74' ' ' ILE . 8.6 p -61.24 -24.77 66.6 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.429 0.633 . . . . 0.7 110.694 -176.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.0 m -74.95 -29.71 61.01 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.847 -1.069 . . . . 1.34 110.501 176.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.429 ' OE1' HD22 ' A' ' 68' ' ' LEU . 50.2 mt-30 -82.0 -49.47 10.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.475 -0.784 . . . . 1.42 110.504 -177.339 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.699 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.7 mp -66.17 -28.77 69.03 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.086 -0.709 . . . . 1.37 109.086 176.127 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 67.9 t60 64.45 55.26 1.39 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 122.244 1.021 . . . . 2.72 108.253 -176.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.641 HG13 HG22 ' A' ' 69' ' ' THR . 15.5 mm -57.42 112.04 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 113.628 -1.624 . . . . 0.91 110.666 -178.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.781 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.5 -167.45 0.16 Allowed Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 107.424 -1.324 . . . . 0.51 107.424 -169.12 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.781 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.0 Cg_exo -29.03 165.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.303 0 C-N-CA 124.636 3.558 . . . . 0.47 115.037 162.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -34.61 -24.63 0.01 OUTLIER Glycine 0 N--CA 1.474 1.208 0 N-CA-C 117.221 1.648 . . . . 0.4 117.221 -171.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 76' ' ' PRO . 40.1 p -69.1 3.37 2.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 117.956 0.878 . . . . 0.56 112.096 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.11 -14.15 62.2 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.274 0.559 . . . . 0.34 109.961 173.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -78.12 -15.82 58.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.567 . . . . 4.13 109.543 176.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.497 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 36.5 mt-30 -87.87 -22.62 24.32 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.801 0.81 . . . . 1.03 109.672 173.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.528 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 5.8 m -72.35 -48.71 39.67 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.617 -1.174 . . . . 0.48 109.293 170.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.5 ' O ' HG13 ' A' ' 86' ' ' VAL . 84.8 t80 -70.69 -15.59 62.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.021 -0.991 . . . . 1.18 110.047 173.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.662 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.1 tt0 -64.7 -49.07 72.35 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.167 0.508 . . . . 0.8 110.276 175.334 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.416 ' H ' ' HG3' ' A' ' 85' ' ' GLN . 64.1 mt-30 -43.07 -44.8 5.02 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.525 -1.216 . . . . 1.62 111.318 178.504 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.966 ' HA ' ' HA2' ' B' 1005 ' ' GLY . 0.9 OUTLIER -86.15 -44.53 16.74 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.335 0 CA-C-N 113.835 -1.53 . . . . 1.3 111.829 -172.645 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.662 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.8 p -62.23 -23.53 32.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.98 0.895 . . . . 0.85 109.876 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.73 -48.52 74.31 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.357 -1.292 . . . . 0.91 110.917 176.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.714 ' HB3' ' HB2' ' B' 1009 ' ' ALA . 5.6 mm-40 -69.15 -43.56 74.06 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-O 122.443 1.116 . . . . 2.87 108.815 178.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.597 ' HG ' ' NH1' ' A' ' 99' ' ' ARG . 8.4 tp -54.86 -24.98 25.71 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 112.312 -2.222 . . . . 1.28 111.518 -173.312 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.506 ' O ' HG23 ' A' ' 95' ' ' VAL . 76.1 t80 -100.04 -35.67 9.62 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.637 0.732 . . . . 2.3 110.935 -173.06 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.544 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 7.5 ptm180 -77.82 -35.26 51.5 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.502 -0.772 . . . . 5.06 111.42 -172.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -93.22 20.64 6.74 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.411 -0.813 . . . . 3.12 112.753 -169.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.584 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 128.02 68.59 0.14 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 117.167 -2.444 . . . . 2.31 115.935 174.556 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.569 ' HA ' ' HE ' ' A' ' 99' ' ' ARG . 67.8 t -73.31 98.43 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 118.649 1.225 . . . . 1.06 111.611 177.528 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -112.45 -170.78 1.73 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.327 -1.306 . . . . 2.12 108.996 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.754 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 22.5 m-90 -63.63 -63.54 1.14 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.9 0.381 . . . . 3.34 110.666 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.427 ' O ' HG22 ' A' ' 101' ' ' VAL . . . -67.11 -26.66 73.35 Favored Glycine 0 C--O 1.225 -0.411 0 CA-C-N 115.933 -0.576 . . . . 0.69 112.723 -177.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.598 ' HD2' ' O ' ' A' ' 99' ' ' ARG . 1.7 tmm_? -58.23 -40.16 80.95 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.936 0.398 . . . . 4.24 110.268 178.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 52.6 mt -67.8 -28.18 40.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.522 -0.308 . . . . 0.44 111.656 -175.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.445 ' O ' ' HD1' ' A' ' 104' ' ' PHE . 0.8 OUTLIER -64.03 -25.88 39.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.308 0.575 . . . . 1.35 110.079 176.472 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.482 ' HA ' ' CD2' ' A' ' 57' ' ' PHE . . . -66.94 -39.79 87.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.735 0.779 . . . . 0.44 110.327 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.463 ' HB2' HH12 ' A' ' 99' ' ' ARG . 28.0 t80 -64.0 -46.17 85.74 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.366 -1.288 . . . . 1.49 110.914 -178.098 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.595 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.1 OUTLIER -80.36 -18.69 48.29 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.529 -0.468 . . . . 3.29 110.553 -178.283 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.706 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 35.3 t -75.17 -57.5 3.85 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.383 -0.371 . . . . 1.19 110.59 178.369 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -68.3 -24.19 64.82 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 109.498 -0.556 . . . . 2.89 109.498 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.469 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -67.12 -42.3 91.8 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.69 -0.767 . . . . 0.3 111.467 172.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.877 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.82 -31.29 79.28 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.66 -0.781 . . . . 0.23 111.396 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.697 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -75.2 -33.05 61.37 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.69 -0.255 . . . . 0.31 110.553 176.263 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -39.4 83.62 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 107.956 -1.127 . . . . 1.12 107.956 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.771 ' SG ' HG22 ' A' ' 123' ' ' VAL . 29.9 t -49.57 -62.92 1.28 Allowed 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 113.368 -1.742 . . . . 0.26 110.204 172.046 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.887 ' HA ' HG13 ' A' ' 115' ' ' VAL . 46.8 t -63.18 -34.54 67.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.384 -0.371 . . . . 0.35 111.48 -176.347 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.62 ' HB3' HG21 ' A' ' 74' ' ' ILE . 36.7 mt-10 -55.91 -25.32 42.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.097 0.475 . . . . 2.51 110.418 176.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.44 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 65.0 m -85.0 -41.46 15.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.485 -0.931 . . . . 0.28 108.485 -178.372 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.887 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.4 m -69.14 -29.74 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.349 0 CA-C-N 114.734 -1.121 . . . . 1.23 109.422 -177.43 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -51.31 -51.03 58.01 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.205 -1.816 . . . . 0.6 111.563 175.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -83.52 10.59 8.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.724 -0.671 . . . . 1.62 109.743 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.613 ' HA ' ' NE2' ' A' ' 120' ' ' GLN . 36.0 mt-10 63.31 55.82 1.79 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 122.159 0.981 . . . . 1.88 109.805 -176.024 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 24.6 mtm -134.96 37.36 3.04 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.848 -1.524 . . . . 0.31 107.553 179.054 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.702 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 4.9 mp0 -52.28 -7.36 0.06 Allowed 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 114.903 -1.044 . . . . 1.15 113.353 -178.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.447 HG23 HD22 ' A' ' 122' ' ' LEU . 27.0 m -67.41 -22.41 28.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 121.464 -0.773 . . . . 0.46 111.921 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.715 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.5 mm? -71.6 -24.77 61.95 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.014 0.435 . . . . 0.26 109.928 178.061 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.771 HG22 ' SG ' ' A' ' 111' ' ' CYS . 42.3 t -44.92 -49.38 2.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 114.716 -1.129 . . . . 0.25 112.593 -177.793 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.567 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 8.9 t -78.22 -34.83 49.07 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.44 -0.504 . . . . 1.35 110.58 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.715 ' HD2' HD13 ' A' ' 122' ' ' LEU . 66.5 mtt180 -62.85 -49.27 75.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.002 -0.545 . . . . 2.67 110.418 -176.483 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.547 HD12 ' HA ' ' A' ' 111' ' ' CYS . 73.6 mt -57.82 -52.19 60.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.488 -0.778 . . . . 0.23 110.767 178.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.748 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -54.07 -36.68 63.4 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 123.291 0.37 . . . . 0.29 111.339 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.46 -56.13 23.54 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.357 0.599 . . . . 0.28 111.054 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -72.57 -23.7 61.0 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.225 -0.898 . . . . 3.91 111.627 -174.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.545 ' SD ' HG22 ' A' ' 126' ' ' ILE . 88.8 mtp -66.01 -58.72 4.87 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.1 0.476 . . . . 1.08 110.343 174.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.96 -35.65 79.09 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.704 -0.68 . . . . 0.25 110.702 -178.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.6 m -63.47 -46.7 84.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.411 -0.359 . . . . 0.4 110.95 176.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -56.69 -39.12 73.25 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.858 -0.423 . . . . 3.13 109.858 177.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.949 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.9 tt -62.77 -50.98 68.9 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.985 -0.746 . . . . 0.95 108.985 174.198 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -51.46 -49.54 61.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.673 0.62 . . . . 0.46 112.673 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -83.15 -51.29 7.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.041 0.448 . . . . 0.59 112.103 -176.369 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -91.4 -50.46 5.79 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 113.121 0.786 . . . . 1.45 113.121 -170.293 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.949 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -80.61 -45.05 17.93 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.564 0.95 . . . . 1.2 113.564 -168.323 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.605 ' HA ' HD12 ' A' ' 142' ' ' ILE . 28.1 tt0 -47.47 -50.4 49.82 Favored Pre-proline 0 C--N 1.322 -0.612 0 O-C-N 123.686 0.616 . . . . 0.75 112.526 -175.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.576 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 51.8 Cg_exo -52.99 -50.26 14.69 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 121.746 1.63 . . . . 0.56 111.734 176.576 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -58.83 -48.16 82.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.587 -0.733 . . . . 1.2 110.513 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.605 HD12 ' HA ' ' A' ' 139' ' ' GLU . 43.9 mt -49.92 -50.96 17.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.058 -0.519 . . . . 0.32 111.351 176.517 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.58 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 79.2 mm-40 -60.21 -31.45 70.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.559 -0.746 . . . . 0.57 111.587 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.7 mm-40 -65.41 -20.71 66.49 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 121.519 0.676 . . . . 0.78 110.685 177.163 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' ASN . . . . . 0.414 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 18.1 m-80 -111.47 5.84 19.83 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.088 -0.96 . . . . 0.93 110.371 -174.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.01 -47.08 1.06 Allowed Glycine 0 N--CA 1.441 -1.006 0 CA-C-N 115.318 -0.855 . . . . 0.56 113.294 173.228 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' GLY . . . . . 0.559 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 130.16 -172.39 20.24 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.48 -0.867 . . . . 0.49 112.064 -177.569 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 9.0 m-90 -76.08 -35.5 59.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.529 0.204 . . . . 3.57 110.742 -177.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -59.1 -43.94 91.91 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.176 0.512 . . . . 1.96 109.702 175.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.593 ' O ' HD13 ' A' ' 154' ' ' LEU . 95.8 m -60.1 -34.48 73.54 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.29 -0.868 . . . . 0.67 111.021 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.754 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 90.0 t80 -60.68 -41.44 95.09 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.482 -0.487 . . . . 3.0 110.212 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.512 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.5 m -76.03 -26.94 17.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.916 0.389 . . . . 1.15 110.486 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' A' ' 150' ' ' THR . 7.8 mm-40 -56.0 -47.95 76.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.342 0.592 . . . . 1.67 109.56 170.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.593 HD13 ' O ' ' A' ' 150' ' ' THR . 7.4 mp -78.25 -61.25 2.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.2 -0.909 . . . . 1.3 112.902 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -120.83 29.64 7.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.303 0.573 . . . . 4.24 110.423 -168.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.625 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -58.92 166.19 7.89 Favored Glycine 0 CA--C 1.506 -0.473 0 CA-C-N 115.476 -0.784 . . . . 1.1 114.115 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 5.8 t30 . . . . . 0 C--N 1.314 -0.97 0 CA-C-N 113.835 -1.182 . . . . 1.29 111.038 -179.054 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B 1005 ' ' GLY . . . . . 0.966 ' HA2' ' HA ' ' A' ' 86' ' ' VAL . . . . . . . . 0 N--CA 1.435 -1.405 0 N-CA-C 110.287 -1.125 . . . . 1.2 110.287 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -61.08 -42.16 97.99 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.932 0.345 . . . . 2.88 111.932 177.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -70.91 -49.5 45.1 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.342 0.497 . . . . 1.31 112.342 -171.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.722 ' HB2' HG23 ' A' ' 86' ' ' VAL . 2.1 mm? -73.82 -34.93 64.78 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.055 -0.258 . . . . 1.33 110.425 -178.361 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B 1009 ' ' ALA . . . . . 0.714 ' HB2' ' HB3' ' A' ' 89' ' ' GLU . . . -47.22 -47.52 24.47 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.983 0.897 . . . . 0.88 110.377 168.682 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -79.82 -58.42 3.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 114.026 -1.443 . . . . 1.03 111.881 -174.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -61.65 -19.21 62.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 1.67 111.15 -178.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.92 -25.08 72.52 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 121.033 -0.603 . . . . 0.78 113.106 -178.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 31.1 t70 -77.05 5.83 7.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.411 0.624 . . . . 1.9 110.513 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 35.3 m . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.028 -0.533 . . . . 1.44 111.092 -178.69 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.438 ' O ' ' HB3' ' A' ' 6' ' ' ARG . 24.3 mp0 . . . . . 0 CA--C 1.522 -0.107 0 CA-C-O 121.021 0.439 . . . . 2.42 110.651 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.528 ' O ' ' HG ' ' A' ' 8' ' ' LEU . 5.1 p -68.7 -32.2 71.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.095 -0.502 . . . . 1.25 111.176 178.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.823 ' HB3' HD13 ' A' ' 134' ' ' LEU . 50.6 m-20 -62.15 -26.66 68.45 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.077 0.465 . . . . 1.78 110.127 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.567 ' O ' HG23 ' A' ' 10' ' ' VAL . 16.9 tpp85 -57.47 -49.36 76.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.491 -0.777 . . . . 1.4 109.81 176.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -57.23 -44.99 84.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.528 -0.76 . . . . 0.68 111.085 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.557 HD22 HG22 ' A' ' 46' ' ' VAL . 8.8 mt -60.65 -29.39 69.24 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.583 -1.189 . . . . 1.16 110.117 -174.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.551 HG21 ' N ' ' A' ' 131' ' ' ALA . 55.9 t -80.65 -59.62 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 115.05 -0.977 . . . . 0.27 110.161 173.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 6' ' ' ARG . 99.4 t -52.28 -54.59 13.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.38 -0.827 . . . . 0.33 112.466 -175.456 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -56.85 -35.86 69.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.996 0.427 . . . . 0.59 110.355 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.532 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 8.2 t80 -72.38 -48.0 45.03 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.84 -0.618 . . . . 1.61 110.469 -178.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.85 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.5 mp -61.66 -42.21 98.6 Favored 'General case' 0 C--N 1.338 0.098 0 C-N-CA 120.793 -0.363 . . . . 0.34 110.516 177.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.8 t -58.97 -45.52 90.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.12 -0.491 . . . . 1.05 110.142 177.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -59.37 -33.83 71.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.469 -0.787 . . . . 1.22 110.936 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.712 ' HE2' ' HA ' ' A' ' 16' ' ' LYS . 8.6 mmpt? -75.96 -30.96 58.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.379 -0.373 . . . . 1.41 111.932 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.552 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -70.25 -27.78 64.71 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.261 -0.576 . . . . 1.35 110.265 176.511 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -58.8 -43.41 90.54 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.879 -0.601 . . . . 0.94 112.315 -178.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -72.45 -2.75 20.68 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.28 0.562 . . . . 1.37 111.551 -177.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.603 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 18.3 mmmt -109.64 -26.25 9.99 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.945 0.879 . . . . 2.2 109.014 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.14 22.1 11.04 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 113.829 -1.532 . . . . 0.53 111.171 178.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.603 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 95.1 m-85 -114.17 165.52 12.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.942 0.401 . . . . 0.76 110.827 -179.036 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.8 t -110.92 141.33 44.48 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.758 -0.656 . . . . 0.52 109.906 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -65.72 -46.12 80.13 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.113 -0.494 . . . . 3.36 110.01 174.069 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.3 p -64.75 -36.52 84.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.748 -0.66 . . . . 1.37 111.836 -172.065 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.69 -31.01 69.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.073 0.463 . . . . 1.11 111.24 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.502 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 15.8 m-85 -112.54 13.54 20.08 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.892 -0.594 . . . . 1.28 110.441 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.568 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 79.8 p -96.76 -179.29 4.53 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 121.69 0.757 . . . . 1.81 111.511 -176.351 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.496 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.2 t70 -164.86 -26.06 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.98 -1.464 . . . . 2.31 107.753 -177.389 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.938 HG23 ' H ' ' A' ' 31' ' ' GLU . 8.9 m -59.81 -75.11 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 113.734 -1.575 . . . . 0.92 112.331 -177.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.938 ' H ' HG23 ' A' ' 30' ' ' VAL . 12.3 mm-40 -80.72 -7.87 59.49 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.618 -0.882 . . . . 2.74 108.618 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 25.2 tt0 . . . . . 0 N--CA 1.443 -0.792 0 CA-C-N 114.174 -1.376 . . . . 1.45 110.528 177.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.825 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.3 t . . . . . 0 CA--C 1.54 0.569 0 CA-C-O 120.594 0.235 . . . . 1.12 110.725 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.825 ' H ' HG23 ' A' ' 41' ' ' THR . 15.9 pt-20 -95.56 -26.5 15.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.589 1.185 . . . . 2.02 108.762 167.309 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.774 ' HB2' ' HE3' ' A' ' 47' ' ' LYS . 1.4 p -55.78 -39.67 71.57 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 112.407 -2.179 . . . . 1.25 114.56 -169.229 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -39.66 -53.74 2.13 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.895 0.747 . . . . 1.91 112.792 -169.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.15 -36.24 58.86 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.94 0.348 . . . . 0.52 111.94 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.622 ' HB ' ' HB3' ' A' ' 148' ' ' TRP . 0.8 OUTLIER -69.98 -44.88 78.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 121.012 -0.275 . . . . 1.41 110.888 -176.787 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.774 ' HE3' ' HB2' ' A' ' 43' ' ' SER . 18.1 ptpt -64.16 -41.28 97.22 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.422 -0.584 . . . . 0.67 109.422 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.508 ' OE1' ' HD2' ' A' ' 51' ' ' ARG . 6.3 mm-40 -56.89 -34.93 68.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.357 -0.838 . . . . 0.99 111.545 174.296 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.714 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -78.61 -33.86 47.11 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.234 0.54 . . . . 0.42 110.501 178.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 12.5 mt -63.38 -33.66 76.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.484 -0.78 . . . . 1.33 112.306 -177.165 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.508 ' HD2' ' OE1' ' A' ' 48' ' ' GLN . 8.3 ptp180 -79.49 -29.25 41.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.592 0.71 . . . . 2.17 109.178 -174.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -70.27 -43.78 69.77 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.29 -1.323 . . . . 1.1 110.655 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.28 -43.68 69.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.823 -0.626 . . . . 0.53 110.526 176.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.633 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.66 -39.09 96.1 Favored Glycine 0 C--O 1.226 -0.346 0 CA-C-N 115.852 -0.613 . . . . 0.7 111.815 178.069 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -53.59 -43.58 68.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.024 0.44 . . . . 1.04 110.463 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.675 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 37.5 mt-10 -69.97 -38.4 76.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.891 -0.595 . . . . 2.29 111.268 177.6 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.515 ' HE2' ' CZ ' ' A' ' 106' ' ' PHE . 7.3 t80 -65.16 -33.0 74.98 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.363 -0.381 . . . . 2.29 110.773 -174.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.633 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 33.6 mt-10 -65.35 -47.14 77.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.16 -0.473 . . . . 1.3 110.793 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' A' ' 56' ' ' GLU . 4.6 pp -68.67 -31.26 70.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 1.54 110.638 -179.28 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.705 ' HB3' ' SG ' ' B' 1014 ' ' CYS . 47.3 mtt180 -68.77 -35.94 77.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.586 0.708 . . . . 2.58 110.186 178.403 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.704 ' HB3' ' HB3' ' A' ' 65' ' ' PHE . 0.2 OUTLIER -91.5 0.04 57.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.925 -1.034 . . . . 5.32 112.089 -177.718 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -35.81 -39.44 0.15 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.125 1.158 . . . . 4.48 114.125 -172.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.405 ' HD2' HH11 ' A' ' 63' ' ' ARG . 34.6 ttm180 -75.46 -42.98 51.9 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 122.181 -0.324 . . . . 4.72 111.7 -175.289 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.52 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -91.91 -41.19 10.73 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.786 0.661 . . . . 1.17 112.786 -174.748 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.704 ' HB3' ' HB3' ' A' ' 61' ' ' TYR . 5.5 p90 -49.49 -40.71 38.39 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.524 0.935 . . . . 2.81 113.524 -164.12 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.5 t -91.03 -42.36 10.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.934 0.397 . . . . 2.19 110.39 -177.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -59.2 -28.64 66.83 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.619 0.723 . . . . 2.72 110.955 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.635 ' O ' HD12 ' A' ' 72' ' ' LEU . 1.8 mp -62.42 -17.06 58.41 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.029 -0.987 . . . . 1.56 113.263 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.698 HG22 HG13 ' A' ' 74' ' ' ILE . 12.6 p -62.65 -22.9 66.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 118.397 0.544 . . . . 0.7 112.058 -175.438 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.7 t -76.15 -35.14 59.35 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.017 -0.735 . . . . 1.34 109.017 174.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.501 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 36.8 mt-30 -69.2 -47.41 64.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.816 -1.084 . . . . 1.42 109.785 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.635 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mt -70.53 -32.02 69.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.602 -0.726 . . . . 1.37 110.109 177.269 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 60.74 63.95 1.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.999 0.904 . . . . 2.72 108.861 -172.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.761 HG21 ' HB3' ' A' ' 113' ' ' GLU . 29.3 mm -60.64 115.05 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 114.006 -1.452 . . . . 0.91 111.382 -178.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.773 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -155.58 -172.26 0.31 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 107.963 -1.125 . . . . 0.51 107.963 -171.463 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.773 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 17.8 Cg_exo -31.05 167.36 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.327 0 C-N-CA 125.029 3.819 . . . . 0.47 115.091 165.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.501 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.85 -27.16 0.01 OUTLIER Glycine 0 N--CA 1.476 1.331 0 N-CA-C 117.372 1.709 . . . . 0.4 117.372 -174.176 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.458 ' N ' ' O ' ' A' ' 76' ' ' PRO . 24.9 p -68.48 -0.36 4.92 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 117.909 0.855 . . . . 0.56 111.925 177.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.32 -14.75 62.72 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.295 0.569 . . . . 0.34 109.621 170.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -73.33 -25.99 60.85 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.577 -0.738 . . . . 4.13 109.553 173.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.448 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 78.2 mt-30 -80.71 -31.98 35.94 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.902 0.858 . . . . 1.03 109.092 177.402 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.3 m -63.62 -54.21 39.43 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.015 -1.448 . . . . 0.48 110.005 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.47 ' HA ' HG23 ' A' ' 86' ' ' VAL . 79.7 t80 -70.41 -18.49 63.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.365 -0.834 . . . . 1.18 110.717 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.608 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.6 tt0 -59.21 -50.25 74.76 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.692 -0.686 . . . . 0.8 110.46 176.491 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.488 ' O ' ' HG2' ' A' ' 89' ' ' GLU . 80.5 mt-30 -47.62 -32.45 5.57 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.596 -1.184 . . . . 1.62 110.769 175.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.998 HG13 ' HG ' ' B' 1008 ' ' LEU . 1.6 t -84.1 -54.7 8.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-N 114.552 -1.203 . . . . 1.3 110.879 -176.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.608 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.3 p -60.69 -29.65 45.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.83 -0.623 . . . . 0.85 109.989 -176.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.734 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 0.7 OUTLIER -58.22 -50.09 74.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.758 -1.11 . . . . 0.91 110.687 175.929 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 1.002 ' HB3' ' HB2' ' B' 1009 ' ' ALA . 35.7 mm-40 -64.26 -42.79 96.32 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 122.331 1.062 . . . . 2.87 109.391 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.489 ' HA ' HD12 ' A' ' 90' ' ' LEU . 0.3 OUTLIER -58.14 -25.48 61.49 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 112.692 -2.049 . . . . 1.28 112.814 -165.906 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.597 ' HA ' HG22 ' A' ' 95' ' ' VAL . 15.9 p90 -106.28 -22.15 12.91 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.62 -0.432 . . . . 2.3 112.071 -174.601 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.734 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.7 OUTLIER -94.24 -29.59 15.01 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-O 121.257 0.551 . . . . 5.06 111.298 -175.557 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.561 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 37.6 t70 -90.31 7.48 38.19 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.637 -0.71 . . . . 3.12 112.685 -168.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 129.59 70.63 0.12 Allowed Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 117.125 -2.464 . . . . 2.31 114.345 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.597 HG22 ' HA ' ' A' ' 91' ' ' PHE . 48.6 t -71.65 101.52 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 122.399 1.095 . . . . 1.06 111.302 -179.462 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.475 ' H ' ' CB ' ' A' ' 99' ' ' ARG . 1.1 m-20 -111.47 -179.87 3.83 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 113.745 -1.57 . . . . 2.12 108.293 177.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.573 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 5.1 m95 -60.93 -52.43 65.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.81 0.338 . . . . 3.34 111.002 177.146 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.88 -20.0 75.69 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.926 -0.654 . . . . 0.69 112.697 -179.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.475 ' CB ' ' H ' ' A' ' 96' ' ' ASN . 4.7 tpp180 -67.24 -40.61 86.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.404 0.621 . . . . 4.24 110.015 179.496 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.533 HG22 ' CE2' ' A' ' 104' ' ' PHE . 69.8 mt -72.17 -39.39 64.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.407 -0.815 . . . . 0.44 110.125 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 97' ' ' TRP . 55.2 t -53.44 -46.99 59.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.837 -0.619 . . . . 1.35 110.233 172.278 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 99' ' ' ARG . . . -49.31 -51.71 32.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.179 -0.918 . . . . 0.44 110.888 174.666 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -54.63 -44.52 73.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.252 -0.886 . . . . 1.49 110.961 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.562 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 57.3 m-85 -64.77 -43.27 93.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.646 0.26 . . . . 3.29 111.146 176.033 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.515 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 27.3 m -60.9 -49.97 75.31 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.181 -0.463 . . . . 1.19 110.864 -177.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.515 ' CZ ' ' HE2' ' A' ' 57' ' ' PHE . 33.0 m-85 -72.23 -33.63 67.7 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.399 -0.364 . . . . 2.89 110.875 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.706 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -69.07 -41.63 80.37 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.569 -0.825 . . . . 0.3 111.879 177.302 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.85 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.46 -37.55 90.12 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.75 -0.738 . . . . 0.23 111.483 176.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.21 -28.54 64.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.768 0.318 . . . . 0.31 110.482 176.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.607 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -64.02 -43.17 96.42 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 108.209 -1.034 . . . . 1.12 108.209 179.286 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.661 ' HB2' HD23 ' A' ' 13' ' ' LEU . 19.5 t -53.27 -55.03 27.85 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 113.861 -1.518 . . . . 0.26 110.534 173.317 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.437 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 71.8 t -63.36 -41.28 92.16 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-N 116.127 -0.488 . . . . 0.35 111.624 -178.447 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.761 ' HB3' HG21 ' A' ' 74' ' ' ILE . 37.2 mm-40 -63.7 -21.95 66.66 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.052 0.453 . . . . 2.51 111.254 178.935 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.523 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 36.9 m -76.2 -40.86 51.24 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.618 -0.882 . . . . 0.28 108.618 172.692 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 111' ' ' CYS . 81.0 t -66.62 -37.37 79.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.967 0.889 . . . . 1.23 109.628 -178.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -52.41 -50.21 62.96 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 113.38 -1.736 . . . . 0.6 111.37 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.507 ' HE2' ' O ' ' A' ' 113' ' ' GLU . 11.2 mmtt -90.73 14.96 12.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.491 . . . . 1.62 110.525 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 63.55 53.12 2.14 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.81 0.814 . . . . 1.88 111.075 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.543 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 25.5 mtm -130.1 44.27 2.99 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.804 -1.089 . . . . 0.31 108.073 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.494 ' HG2' HG13 ' A' ' 115' ' ' VAL . 4.5 mt-30 -60.92 -7.57 2.51 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.786 -1.097 . . . . 1.15 113.068 -174.475 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.534 HG23 HD22 ' A' ' 122' ' ' LEU . 35.0 m -65.43 -26.04 38.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 122.225 -0.297 . . . . 0.46 111.089 175.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.74 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -72.51 -27.75 62.45 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.463 -0.335 . . . . 0.26 110.536 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.633 HG22 ' SG ' ' A' ' 111' ' ' CYS . 68.0 t -43.65 -53.03 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 O-C-N 123.968 0.793 . . . . 0.25 111.936 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.568 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 10.3 t -72.14 -40.46 68.04 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.748 0.309 . . . . 1.35 110.932 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.74 ' HD2' HD13 ' A' ' 122' ' ' LEU . 92.0 mtt180 -59.98 -53.86 52.85 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 116.158 -0.474 . . . . 2.67 110.589 -176.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.635 ' HA ' ' CZ2' ' A' ' 129' ' ' TRP . 87.2 mt -52.41 -48.4 45.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.361 -0.836 . . . . 0.23 110.99 -178.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.563 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -60.14 -27.46 67.1 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.147 0.425 . . . . 0.29 112.147 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.78 -61.41 2.08 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 121.486 0.66 . . . . 0.28 110.358 -177.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.635 ' CZ2' ' HA ' ' A' ' 126' ' ' ILE . 27.3 p-90 -80.03 -18.07 51.13 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.169 -0.923 . . . . 3.91 111.799 -176.423 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.706 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 12.4 mmm -58.12 -54.1 50.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.396 0.617 . . . . 1.08 109.446 168.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.551 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -64.63 -41.52 96.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.586 -0.734 . . . . 0.25 110.888 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.541 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 70.1 m -57.9 -50.32 73.73 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.98 0.363 . . . . 0.4 111.98 176.569 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.544 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 4.4 m-85 -59.34 -34.77 72.76 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.263 -0.175 . . . . 3.13 111.194 -178.211 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.823 HD13 ' HB3' ' A' ' 5' ' ' ASN . 4.2 tt -62.02 -55.99 23.63 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.218 -1.03 . . . . 0.95 108.218 170.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.0 m-80 -47.08 -51.3 18.01 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.114 -0.948 . . . . 0.46 112.606 -178.588 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -84.76 -45.78 12.05 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.203 0.446 . . . . 0.59 112.203 -173.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' HIS . . . . . 0.544 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 18.3 m-70 -91.02 -49.92 6.14 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.734 0.642 . . . . 1.45 112.734 -171.118 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 134' ' ' LEU . 46.7 mt -91.06 -36.75 13.85 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.784 0.661 . . . . 1.2 112.784 -165.832 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.637 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 31.5 tt0 -49.77 -50.73 65.7 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 123.54 0.525 . . . . 0.75 112.25 -173.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.597 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 35.2 Cg_exo -57.19 -49.84 12.9 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 121.61 1.54 . . . . 0.56 111.494 176.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' TRP . . . . . 0.426 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 4.0 t-105 -57.74 -49.26 77.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.489 -0.778 . . . . 1.2 110.477 -178.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.619 HD12 ' HA ' ' A' ' 139' ' ' GLU . 47.0 mt -45.27 -53.32 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 122.953 0.501 . . . . 0.32 111.655 173.512 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.637 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.7 mm-40 -59.4 -32.35 70.08 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.91 -0.586 . . . . 0.57 111.513 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.2 mm-40 -66.42 -19.38 65.78 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.248 0.547 . . . . 0.78 110.909 178.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -109.75 2.5 20.11 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.478 -0.783 . . . . 0.93 110.725 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 126.87 -48.32 0.97 Allowed Glycine 0 N--CA 1.442 -0.961 0 CA-C-N 115.669 -0.696 . . . . 0.56 113.075 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 126.08 172.67 13.41 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.852 -0.69 . . . . 0.49 111.45 -177.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.622 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 67.1 m95 -65.02 -36.42 84.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.901 0.351 . . . . 3.57 111.611 -176.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.582 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 6.0 p-10 -59.95 -33.03 71.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.836 0.35 . . . . 1.96 110.634 177.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.547 ' O ' HD13 ' A' ' 154' ' ' LEU . 89.4 m -68.04 -39.99 82.93 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.047 -0.524 . . . . 0.67 110.935 178.313 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.573 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 85.9 t80 -61.53 -33.03 73.13 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.942 -0.762 . . . . 3.0 108.942 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.582 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 99.0 t -63.08 -55.71 21.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-N 114.569 -1.196 . . . . 1.15 110.786 174.201 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 9.5 mm-40 -47.76 -46.73 30.46 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.469 -0.787 . . . . 1.67 111.538 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.547 HD13 ' O ' ' A' ' 150' ' ' THR . 8.4 mp -75.68 -61.18 2.01 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.233 0.827 . . . . 1.3 113.233 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -120.79 21.18 11.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.487 -0.324 . . . . 4.24 111.822 -166.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.714 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -67.25 179.08 15.6 Favored Glycine 0 N--CA 1.45 -0.422 0 N-CA-C 115.729 1.051 . . . . 1.1 115.729 -172.169 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 3.5 t30 . . . . . 0 N--CA 1.441 -0.886 0 CA-C-N 113.208 -1.496 . . . . 1.29 110.683 -177.06 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.195 0 N-CA-C 112.774 -0.131 . . . . 1.2 112.774 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B 1006 ' ' ARG . . . . . 0.527 ' HA ' ' CZ ' ' B' 1006 ' ' ARG . 1.6 tpm_? -56.32 -52.3 65.07 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.707 0.765 . . . . 2.88 111.669 172.133 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B 1007 ' ' ALA . . . . . 0.544 ' HB3' HD22 ' B' 1008 ' ' LEU . . . -99.67 -153.5 0.44 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.571 -1.195 . . . . 1.31 110.063 -172.805 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.998 ' HG ' HG13 ' A' ' 86' ' ' VAL . 2.8 mm? 64.43 -74.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 O-C-N 123.963 0.789 . . . . 1.33 111.384 174.373 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B 1009 ' ' ALA . . . . . 1.002 ' HB2' ' HB3' ' A' ' 89' ' ' GLU . . . -46.06 -64.3 0.78 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.632 0.73 . . . . 0.88 110.574 169.138 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B 1010 ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' B' 1013 ' ' ASP . . . -52.5 -40.06 61.97 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 114.597 -1.183 . . . . 1.03 112.43 -178.017 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B 1011 ' ' PHE . . . . . 0.418 ' O ' ' HB2' ' B' 1014 ' ' CYS . 80.6 m-85 -98.75 7.02 46.55 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.188 -0.46 . . . . 1.67 111.297 -172.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.79 -16.89 79.16 Favored Glycine 0 CA--C 1.501 -0.787 0 N-CA-C 108.726 -1.75 . . . . 0.78 108.726 166.282 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B 1013 ' ' ASP . . . . . 0.419 ' HB3' ' O ' ' B' 1010 ' ' ALA . 17.4 t70 -72.78 -2.88 22.19 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.36 -1.42 . . . . 1.9 110.863 171.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B 1014 ' ' CYS . . . . . 0.705 ' SG ' ' HB3' ' A' ' 60' ' ' ARG . 15.3 t . . . . . 0 C--N 1.34 0.177 0 CA-C-O 121.334 0.588 . . . . 1.44 110.057 178.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 . . . . . 0 N--CA 1.46 0.047 0 CA-C-O 120.865 0.364 . . . . 2.42 111.257 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -20.67 66.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.3 -0.409 . . . . 1.25 111.461 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.947 ' HA ' HD22 ' A' ' 8' ' ' LEU . 13.5 m120 -64.65 -22.35 66.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.21 -0.45 . . . . 1.78 110.477 178.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.835 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.2 tpp180 -54.81 -52.95 61.09 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.814 -0.63 . . . . 1.4 110.449 176.651 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.824 ' HB3' ' HE3' ' A' ' 47' ' ' LYS . 46.9 mt-10 -57.94 -46.39 85.13 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.274 -0.876 . . . . 0.68 110.905 -177.498 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.947 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.2 OUTLIER -52.77 -32.49 43.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.078 -0.965 . . . . 1.16 111.217 179.304 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.5 HG21 ' CA ' ' A' ' 131' ' ' ALA . 67.7 t -80.24 -61.1 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.308 0.575 . . . . 0.27 109.8 174.234 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.527 HG13 ' CE2' ' A' ' 24' ' ' TRP . 95.2 t -50.1 -54.77 7.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.815 -1.084 . . . . 0.33 112.506 -175.376 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -49.24 -43.28 42.59 Favored 'General case' 0 CA--C 1.52 -0.205 0 O-C-N 123.472 0.482 . . . . 0.59 110.57 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.617 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 1.6 t80 -72.43 -42.44 65.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.879 -0.6 . . . . 1.61 111.077 -175.621 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.993 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.2 mp -62.75 -40.39 97.11 Favored 'General case' 0 C--O 1.231 0.124 0 C-N-CA 120.277 -0.569 . . . . 0.34 110.185 177.027 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.7 m -62.57 -39.11 92.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.553 0.692 . . . . 1.05 109.929 176.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -63.81 -18.7 64.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.739 -1.118 . . . . 1.22 111.024 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.681 ' HE2' ' HA ' ' A' ' 16' ' ' LYS . 10.7 mmpt? -90.57 -52.77 4.73 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.31 0.576 . . . . 1.41 110.054 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.61 HD23 HG22 ' A' ' 112' ' ' VAL . 13.6 mt -55.36 -31.41 61.73 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.687 -1.142 . . . . 1.35 111.419 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.8 t -60.41 -31.1 70.07 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.962 -0.563 . . . . 0.94 111.621 177.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -75.68 -21.42 57.64 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-O 121.792 0.806 . . . . 1.37 110.448 -178.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.537 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 9.8 mmmt -96.45 -26.58 15.26 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.224 -1.353 . . . . 2.2 108.665 -174.507 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.03 19.4 17.08 Favored Glycine 0 N--CA 1.437 -1.295 0 CA-C-N 113.744 -1.571 . . . . 0.53 111.976 176.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.537 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 31.8 m-85 -99.63 154.9 17.91 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.753 0.311 . . . . 0.76 110.343 177.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.0 t -92.29 142.81 27.05 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.998 -0.546 . . . . 0.52 109.572 175.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.527 ' CE2' HG13 ' A' ' 10' ' ' VAL . 27.9 t-105 -74.5 -49.44 22.13 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.622 -0.51 . . . . 3.36 109.622 176.079 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.8 m -58.94 -35.89 73.86 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.771 -0.65 . . . . 1.37 111.725 -176.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -61.64 -25.78 67.58 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.894 0.378 . . . . 1.11 111.965 -178.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -120.24 19.15 12.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.358 -0.383 . . . . 1.28 110.933 -178.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.459 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 37.4 p -100.26 -178.85 3.95 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.625 0.726 . . . . 1.81 112.097 -172.153 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.519 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 5.4 t70 -161.52 -23.9 0.05 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.403 -1.271 . . . . 2.31 108.899 -178.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.866 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.4 m -53.91 -72.43 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 114.269 -1.332 . . . . 0.92 112.827 -175.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.866 ' H ' HG23 ' A' ' 30' ' ' VAL . 32.4 mt-10 -89.69 -4.26 57.82 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.632 -0.877 . . . . 2.74 108.632 178.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.519 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 23.2 tt0 . . . . . 0 N--CA 1.443 -0.802 0 CA-C-N 114.45 -1.25 . . . . 1.45 111.222 -175.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.805 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.2 t . . . . . 0 CA--C 1.54 0.584 0 CA-C-O 120.537 0.208 . . . . 1.12 110.547 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.805 ' H ' HG23 ' A' ' 41' ' ' THR . 14.2 pt-20 -92.88 -30.95 15.15 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 122.27 1.033 . . . . 2.02 108.315 168.529 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.456 ' HA ' HG13 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -56.57 -35.57 68.33 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 112.742 -2.027 . . . . 1.25 113.425 -170.932 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -45.17 -53.48 8.09 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 123.967 0.792 . . . . 1.91 111.721 -173.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.453 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -72.39 -38.96 68.34 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.794 0.294 . . . . 0.52 111.794 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.68 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 1.4 m -71.47 -41.71 72.92 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 120.939 -0.305 . . . . 1.41 111.016 -175.046 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.824 ' HE3' ' HB3' ' A' ' 7' ' ' GLU . 0.4 OUTLIER -71.77 -30.24 65.35 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.298 -0.63 . . . . 0.67 109.298 178.742 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.525 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 13.6 mm-40 -64.61 -35.68 81.79 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.99 110.266 172.307 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.643 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -75.65 -34.23 60.5 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.114 -0.493 . . . . 0.42 110.597 176.517 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.68 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 12.5 mt -64.02 -28.0 69.5 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 115.514 -0.767 . . . . 1.33 112.364 -176.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.501 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 7.9 ptm180 -81.07 -30.72 34.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.861 0.839 . . . . 2.17 108.998 -176.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -74.99 -49.93 18.28 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.172 -1.376 . . . . 1.1 109.786 -178.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.415 ' CB ' ' HZ ' ' A' ' 151' ' ' PHE . . . -65.45 -34.12 77.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.724 -0.671 . . . . 0.53 109.87 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.761 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -58.7 -57.33 20.42 Favored Glycine 0 N--CA 1.442 -0.911 0 CA-C-N 115.262 -0.881 . . . . 0.7 111.758 177.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -55.12 -43.16 73.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.807 0.337 . . . . 1.04 111.265 -177.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -59.5 -34.25 72.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.771 -0.65 . . . . 2.29 111.479 177.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.621 ' CE1' ' HA2' ' B' 1012 ' ' GLY . 67.0 t80 -81.6 -40.48 22.93 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.912 -0.585 . . . . 2.29 111.323 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.761 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 56.9 mt-10 -62.92 -42.19 99.72 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.314 -0.403 . . . . 1.3 111.745 -173.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.1 pp -59.73 -19.09 47.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.22 -0.446 . . . . 1.54 111.526 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 32.8 mtp-105 -79.7 -53.67 6.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.087 -0.506 . . . . 2.58 110.953 -179.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.647 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 15.3 p90 -92.18 -5.72 52.04 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.672 0.619 . . . . 5.32 112.672 -172.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.807 ' HG3' ' HE1' ' A' ' 65' ' ' PHE . 50.8 ttt180 -50.99 -38.49 51.45 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.28 0.474 . . . . 4.48 112.28 -170.286 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -52.85 -38.14 61.11 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.051 0.389 . . . . 4.72 112.051 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.427 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -82.78 -48.82 10.39 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 112.906 0.706 . . . . 1.17 112.906 -172.091 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.807 ' HE1' ' HG3' ' A' ' 62' ' ' ARG . 5.1 p90 -60.04 -26.99 66.55 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.49 0.552 . . . . 2.81 112.49 -166.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.1 t -68.02 -32.71 73.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.154 0.502 . . . . 2.19 110.106 177.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -90.13 -25.82 20.5 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.583 0.706 . . . . 2.72 110.397 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.69 ' O ' HD12 ' A' ' 72' ' ' LEU . 2.0 mp -75.31 -18.02 60.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.292 -0.867 . . . . 1.56 112.424 -176.101 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.709 HG22 HG13 ' A' ' 74' ' ' ILE . 1.2 p -57.3 -34.42 68.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 118.147 0.431 . . . . 0.7 111.043 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 45.6 t -63.88 -41.7 97.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.385 0.612 . . . . 1.34 109.924 173.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.657 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 35.1 mt-30 -66.77 -39.12 87.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.113 -0.949 . . . . 1.42 110.652 -178.196 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.69 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mt -76.2 -30.15 57.89 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.552 -0.749 . . . . 1.37 110.408 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 68.55 50.72 0.67 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.447 0.642 . . . . 2.72 109.616 -176.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.709 HG13 HG22 ' A' ' 69' ' ' THR . 25.5 mm -55.47 114.93 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.609 -1.178 . . . . 0.91 111.419 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.765 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.95 -170.24 0.24 Allowed Pre-proline 0 CA--C 1.549 0.923 0 N-CA-C 107.514 -1.291 . . . . 0.51 107.514 -171.566 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.765 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 32.2 Cg_exo -29.33 167.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.128 0 C-N-CA 125.218 3.945 . . . . 0.47 115.326 162.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -28.56 -27.46 0.0 OUTLIER Glycine 0 N--CA 1.475 1.239 0 N-CA-C 117.828 1.891 . . . . 0.4 117.828 -173.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.469 ' N ' ' O ' ' A' ' 76' ' ' PRO . 40.7 p -65.67 1.93 1.13 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 118.946 1.373 . . . . 0.56 112.0 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.26 -12.16 60.76 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.551 -0.295 . . . . 0.34 110.262 174.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.463 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 2.8 m-85 -73.62 -22.85 59.88 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.644 -0.872 . . . . 4.13 108.644 174.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.408 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 33.5 mt-30 -81.95 -26.15 34.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.392 -0.822 . . . . 1.03 109.725 176.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.647 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 3.2 m -73.54 -51.51 16.72 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.63 -1.168 . . . . 0.48 109.05 172.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.46 ' HB2' ' HG ' ' A' ' 110' ' ' LEU . 69.3 t80 -67.66 -17.89 64.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.115 -0.948 . . . . 1.18 110.276 176.378 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.552 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.5 tt0 -61.64 -50.56 72.05 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.925 -0.579 . . . . 0.8 110.409 177.596 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -47.23 -33.33 5.31 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 114.856 -1.066 . . . . 1.62 110.311 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.872 HG13 HD12 ' B' 1008 ' ' LEU . 1.3 t -85.91 -55.13 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.981 0 CA-C-N 114.01 -1.45 . . . . 1.3 110.912 -174.809 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.552 HG12 ' HA ' ' A' ' 84' ' ' GLU . 4.9 p -62.86 -17.95 20.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-O 122.098 0.951 . . . . 0.85 109.959 -176.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.547 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 4.5 m-80 -86.02 -35.58 20.26 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.148 -1.387 . . . . 0.91 112.057 176.073 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 1.022 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.2 pp20? -74.65 -35.58 62.85 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 122.107 0.956 . . . . 2.87 108.518 177.348 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.625 HD12 ' HD2' ' A' ' 99' ' ' ARG . 0.1 OUTLIER -67.13 -33.36 75.28 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 113.569 -1.651 . . . . 1.28 110.879 -167.921 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.671 ' HA ' HG22 ' A' ' 95' ' ' VAL . 2.9 p90 -98.53 -16.62 19.09 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.774 -0.37 . . . . 2.3 111.097 -174.006 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.615 ' CD ' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -88.81 -30.15 19.19 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.35 -0.54 . . . . 5.06 111.139 -177.179 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -92.24 2.63 56.5 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.662 0.616 . . . . 3.12 112.662 -168.08 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 131.67 71.78 0.1 OUTLIER Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 117.339 -2.362 . . . . 2.31 114.954 -174.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.671 HG22 ' HA ' ' A' ' 91' ' ' PHE . 49.1 t -70.14 98.52 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 118.144 0.972 . . . . 1.06 110.492 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.452 ' H ' ' CB ' ' A' ' 99' ' ' ARG . 3.0 m-20 -108.93 -179.06 3.75 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.311 -1.313 . . . . 2.12 108.902 178.1 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.809 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 19.3 m-90 -51.37 -52.9 41.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.224 0.535 . . . . 3.34 111.015 176.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.521 ' O ' ' HB ' ' A' ' 101' ' ' VAL . . . -81.36 -14.18 79.12 Favored Glycine 0 CA--C 1.519 0.324 0 CA-C-N 115.759 -0.655 . . . . 0.69 113.637 -175.295 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.625 ' HD2' HD12 ' A' ' 90' ' ' LEU . 9.4 tpp180 -63.21 -42.4 99.28 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.291 0.567 . . . . 4.24 110.496 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.569 HG22 ' CE2' ' A' ' 104' ' ' PHE . 89.8 mt -72.89 -33.61 44.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.671 . . . . 0.44 110.438 -179.438 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.521 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 72.8 t -49.1 -54.45 5.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.764 -0.653 . . . . 1.35 109.804 168.747 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.423 ' HB1' ' CE2' ' A' ' 106' ' ' PHE . . . -52.49 -47.22 66.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.886 -1.052 . . . . 0.44 111.126 175.783 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.404 ' CE1' HG23 ' A' ' 87' ' ' VAL . 9.7 t80 -55.56 -39.67 70.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.579 -0.737 . . . . 1.49 111.395 178.408 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.569 ' CE2' HG22 ' A' ' 100' ' ' ILE . 30.7 m-85 -69.92 -33.74 72.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.632 0.253 . . . . 3.29 110.88 175.234 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.617 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 18.1 t -68.58 -53.84 20.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.484 -0.325 . . . . 1.19 110.674 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.553 ' CZ ' ' HB3' ' B' 1008 ' ' LEU . 35.4 m-85 -63.98 -38.63 91.78 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-O 120.552 0.215 . . . . 2.89 110.581 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -69.82 -39.18 76.32 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.619 -0.801 . . . . 0.3 111.792 177.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.993 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.04 -36.19 91.63 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 111.303 -0.719 . . . . 0.23 111.303 176.256 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -73.59 -29.14 62.21 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.229 -0.285 . . . . 0.31 110.229 175.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.46 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -61.3 -40.68 95.07 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 107.723 -1.214 . . . . 1.12 107.723 178.155 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.717 ' SG ' HG22 ' A' ' 123' ' ' VAL . 39.9 t -51.57 -63.73 1.04 Allowed 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 113.612 -1.631 . . . . 0.26 110.174 172.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.896 ' HA ' HG13 ' A' ' 115' ' ' VAL . 43.6 t -64.15 -37.89 81.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.202 0.445 . . . . 0.35 112.202 -174.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.614 ' HB3' HG21 ' A' ' 74' ' ' ILE . 13.6 mm-40 -59.52 -16.95 27.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.185 0.517 . . . . 2.51 110.767 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.578 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 63.9 m -85.1 -46.86 10.74 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 107.997 -1.112 . . . . 0.28 107.997 176.34 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.896 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.7 m -66.38 -34.22 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-N 114.783 -1.099 . . . . 1.23 109.897 -174.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -50.32 -51.31 46.45 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 113.066 -1.879 . . . . 0.6 111.153 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' ' 113' ' ' GLU . 24.1 mmtt -86.0 15.5 4.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.796 -0.638 . . . . 1.62 110.109 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 65.89 49.29 1.67 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 122.037 0.922 . . . . 1.88 110.176 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.578 ' CE ' ' HA ' ' A' ' 114' ' ' SER . 27.9 mtm -129.59 37.12 4.02 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.329 -1.305 . . . . 0.31 107.889 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.771 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 0.0 OUTLIER -54.51 -8.05 0.2 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.921 -1.036 . . . . 1.15 112.684 -179.834 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.578 HG23 HD22 ' A' ' 122' ' ' LEU . 27.3 m -68.25 -22.5 27.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 O-C-N 122.102 -0.374 . . . . 0.46 111.868 176.629 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.615 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.6 mm? -75.26 -24.89 57.66 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 120.956 0.408 . . . . 0.26 110.137 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.717 HG22 ' SG ' ' A' ' 111' ' ' CYS . 46.7 t -45.19 -52.55 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 114.857 -1.065 . . . . 0.25 112.346 -176.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.459 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 0.1 OUTLIER -75.46 -33.59 60.86 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 121.044 0.449 . . . . 1.35 111.196 -178.468 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.615 ' HD2' HD13 ' A' ' 122' ' ' LEU . 74.0 mtt180 -65.97 -52.5 49.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.67 -0.695 . . . . 2.67 110.738 -176.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.553 HG22 ' SD ' ' A' ' 130' ' ' MET . 69.5 mt -53.6 -49.97 52.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.769 -0.651 . . . . 0.23 111.331 179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.641 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.17 -32.53 68.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.624 -0.262 . . . . 0.29 111.58 -177.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.835 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -58.75 -61.68 2.44 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.198 0.523 . . . . 0.28 110.353 176.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -62.11 -35.67 79.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.86 -1.064 . . . . 3.91 111.2 -176.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.553 ' SD ' HG22 ' A' ' 126' ' ' ILE . 88.2 mtp -60.86 -54.59 43.18 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.779 0.323 . . . . 1.08 111.435 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.5 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -62.23 -43.01 99.79 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.26 -0.427 . . . . 0.25 111.004 -178.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 97.2 m -61.4 -44.39 97.23 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.838 -0.345 . . . . 0.4 110.695 177.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.458 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 26.6 t80 -56.7 -40.24 75.27 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.153 -0.314 . . . . 3.13 110.153 178.493 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.925 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 3.8 tt -61.42 -54.88 37.8 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.78 -0.822 . . . . 0.95 108.78 174.099 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -51.75 -44.02 63.16 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.181 -0.918 . . . . 0.46 112.426 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -84.68 -52.69 5.9 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.215 0.531 . . . . 0.59 111.906 -175.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' HIS . . . . . 0.458 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 7.2 m80 -91.4 -51.77 5.12 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 113.124 0.787 . . . . 1.45 113.124 -171.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.925 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -80.74 -45.6 16.8 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.007 1.114 . . . . 1.2 114.007 -165.081 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.712 ' HA ' HD12 ' A' ' 142' ' ' ILE . 27.6 tt0 -44.99 -50.29 26.74 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 112.689 0.626 . . . . 0.75 112.689 -174.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.571 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 51.3 Cg_exo -54.38 -50.87 12.0 Favored 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 121.856 1.704 . . . . 0.56 111.861 176.127 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 -58.02 -49.5 76.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.529 -0.759 . . . . 1.2 110.31 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.712 HD12 ' HA ' ' A' ' 139' ' ' GLU . 61.8 mt -46.58 -53.91 2.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.921 -0.581 . . . . 0.32 111.683 175.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.563 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 72.3 mm-40 -60.14 -30.72 69.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.846 -0.616 . . . . 0.57 111.739 -178.522 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 6.4 mm-40 -68.28 -22.9 64.71 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.354 0.597 . . . . 0.78 110.746 177.161 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -99.54 -20.9 16.15 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.421 -0.808 . . . . 0.93 110.151 -173.071 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 146.7 -33.57 1.4 Allowed Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.791 -0.719 . . . . 0.56 112.686 175.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' GLY . . . . . 0.551 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 110.1 169.92 19.89 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.565 -0.826 . . . . 0.49 111.844 -177.442 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.533 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 65.2 m95 -68.03 -34.39 76.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.731 0.265 . . . . 3.57 111.568 -178.416 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -58.25 -47.1 84.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.067 0.46 . . . . 1.96 110.243 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.542 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 95.4 m -61.0 -35.37 76.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.606 -0.724 . . . . 0.67 111.178 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.809 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 84.0 t80 -59.54 -40.96 88.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.742 0.306 . . . . 3.0 110.672 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.559 HG12 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -73.8 -24.94 20.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.322 0.582 . . . . 1.15 110.089 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.78 -22.45 66.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.066 0.46 . . . . 1.67 109.948 173.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 150' ' ' THR . 5.0 mt -94.33 -58.34 2.24 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.916 -0.584 . . . . 1.3 110.779 177.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -121.25 27.74 8.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.976 -0.556 . . . . 4.24 111.591 -173.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.643 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -65.7 163.43 40.24 Favored Glycine 0 CA--C 1.497 -1.083 0 C-N-CA 120.865 -0.683 . . . . 1.1 113.056 -178.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.525 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 5.6 t30 . . . . . 0 C--N 1.308 -1.23 0 CA-C-N 114.205 -0.998 . . . . 1.29 110.68 178.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.937 0 N-CA-C 113.708 0.243 . . . . 1.2 113.708 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -94.07 -40.48 10.05 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 111.922 0.341 . . . . 2.88 111.922 176.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -78.52 -48.16 15.87 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 113.119 0.785 . . . . 1.31 113.119 -167.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.872 HD12 HG13 ' A' ' 86' ' ' VAL . 7.7 mt -75.22 -37.31 61.17 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.279 -0.637 . . . . 1.33 109.279 -171.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B 1009 ' ' ALA . . . . . 1.022 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -52.86 -49.79 65.09 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.002 -0.999 . . . . 0.88 110.169 169.161 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -68.28 -50.18 55.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.283 -1.326 . . . . 1.03 111.966 -176.106 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -73.14 -23.17 60.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.138 -0.483 . . . . 1.67 111.478 -177.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1012 ' ' GLY . . . . . 0.621 ' HA2' ' CE1' ' A' ' 57' ' ' PHE . . . -74.61 -10.1 82.66 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 121.018 -0.611 . . . . 0.78 113.01 -177.234 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -74.51 -20.96 59.78 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.08 0.467 . . . . 1.9 110.898 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.453 -0.318 0 CA-C-N 116.447 -0.342 . . . . 1.44 110.886 -175.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.08 0.467 . . . . 2.42 110.13 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.11 -17.69 64.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.458 -0.792 . . . . 1.25 112.467 -177.516 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.894 ' HB3' HD13 ' A' ' 134' ' ' LEU . 21.8 m-20 -67.86 -15.76 63.77 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 120.52 -0.472 . . . . 1.78 110.005 178.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.561 HH12 ' HA ' ' A' ' 128' ' ' ALA . 12.3 tpp180 -56.83 -48.91 76.95 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.921 -0.581 . . . . 1.4 109.747 174.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.478 ' HB3' ' CE ' ' A' ' 47' ' ' LYS . 33.9 mt-10 -53.49 -51.81 61.58 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.768 -1.105 . . . . 0.68 111.118 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.623 HD22 ' HA ' ' A' ' 5' ' ' ASN . 1.2 mp -49.13 -35.04 15.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.864 -1.062 . . . . 1.16 111.499 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.523 HG21 ' N ' ' A' ' 131' ' ' ALA . 72.4 t -80.63 -59.54 2.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.837 -0.62 . . . . 0.27 110.375 175.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 6' ' ' ARG . 85.0 t -51.96 -55.64 8.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.852 -1.067 . . . . 0.33 113.059 -176.127 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -54.97 -30.85 60.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.974 0.416 . . . . 0.59 110.493 -176.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.74 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 4.0 t80 -79.18 -51.51 9.41 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.889 -0.596 . . . . 1.61 110.546 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.952 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.0 mp -58.89 -42.95 90.77 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 121.01 -0.276 . . . . 0.34 110.899 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.43 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 38.4 t -58.39 -40.43 82.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.283 0.563 . . . . 1.05 110.424 178.239 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -71.56 -23.75 61.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.795 -0.639 . . . . 1.22 110.289 -179.055 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.631 ' HE2' ' HA ' ' A' ' 16' ' ' LYS . 10.2 mmpt? -85.1 -28.78 25.36 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 116.457 -0.338 . . . . 1.41 110.929 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.481 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -72.73 -26.33 61.54 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.066 -0.654 . . . . 1.35 109.396 172.783 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.7 t -65.18 -33.78 76.82 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.58 -0.736 . . . . 0.94 111.735 -178.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 16.8 pt20 -76.11 -6.04 49.35 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.367 0.603 . . . . 1.37 111.022 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.526 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.5 mmmt -109.01 -27.78 9.46 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.961 0.886 . . . . 2.2 108.854 -178.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.4 23.25 9.69 Favored Glycine 0 N--CA 1.441 -1.009 0 CA-C-N 113.996 -1.457 . . . . 0.53 111.438 177.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.508 ' HD2' ' HZ ' ' A' ' 27' ' ' PHE . 84.4 m-85 -110.55 163.58 13.57 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.033 0.444 . . . . 0.76 111.003 179.504 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.8 t -101.42 145.37 29.04 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.821 -0.627 . . . . 0.52 110.176 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.43 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.5 OUTLIER -69.78 -47.46 62.82 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.044 -0.526 . . . . 3.36 110.713 176.573 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.7 t -75.6 -23.18 56.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.417 -0.356 . . . . 1.37 111.599 -170.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -61.39 -25.47 67.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.222 0.534 . . . . 1.11 111.124 176.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.508 ' HZ ' ' HD2' ' A' ' 22' ' ' TYR . 6.6 m-85 -113.09 -22.21 10.66 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.979 -0.555 . . . . 1.28 111.16 -176.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.581 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 19.3 m -101.24 144.87 29.58 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 122.32 1.057 . . . . 1.81 112.163 -178.655 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -118.18 -5.21 10.92 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.379 -1.737 . . . . 2.31 109.512 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.793 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.4 m -53.57 -73.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.135 -1.393 . . . . 0.92 113.257 -165.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.793 ' H ' HG23 ' A' ' 30' ' ' VAL . 10.4 pt-20 -96.97 2.12 51.15 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.122 -0.696 . . . . 2.74 109.122 177.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 . . . . . 0 N--CA 1.449 -0.516 0 CA-C-N 114.761 -1.108 . . . . 1.45 110.803 179.544 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.894 HG23 ' H ' ' A' ' 42' ' ' GLU . 3.5 t . . . . . 0 CA--C 1.543 0.703 0 N-CA-C 110.543 -0.169 . . . . 1.12 110.543 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.894 ' H ' HG23 ' A' ' 41' ' ' THR . 13.4 pt-20 -94.45 -32.19 13.64 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 122.384 1.088 . . . . 2.02 109.789 171.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.685 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 51.7 m -62.71 -24.53 67.71 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 113.206 -1.815 . . . . 1.25 114.816 -165.736 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -39.42 -55.52 1.75 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.517 0.511 . . . . 1.91 112.251 -172.141 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.475 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -70.52 -40.07 73.72 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.796 0.295 . . . . 0.52 111.796 179.222 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.631 ' HB ' ' HB3' ' A' ' 148' ' ' TRP . 2.0 m -67.74 -44.2 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 121.239 -0.185 . . . . 1.41 111.189 -176.463 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.685 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.8 ptpt -69.93 -39.42 76.12 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.536 -0.542 . . . . 0.67 109.536 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.497 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 33.2 mm-40 -59.1 -33.62 71.05 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.714 -0.676 . . . . 0.99 111.17 174.435 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.54 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -76.83 -39.41 51.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.39 0.614 . . . . 0.42 110.716 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.422 HD12 ' CE2' ' A' ' 151' ' ' PHE . 1.0 OUTLIER -65.79 -25.97 67.48 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.286 -0.87 . . . . 1.33 112.548 -174.63 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.512 ' HG3' ' HG2' ' A' ' 52' ' ' GLU . 8.2 ptp180 -83.34 -27.46 29.7 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.8 0.81 . . . . 2.17 109.335 -175.015 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.512 ' HG2' ' HG3' ' A' ' 51' ' ' ARG . 4.3 mm-40 -80.17 -39.96 28.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.201 -1.363 . . . . 1.1 109.715 -179.273 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.52 -41.57 75.85 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.581 -0.736 . . . . 0.53 109.836 172.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.662 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.13 -31.96 74.65 Favored Glycine 0 C--O 1.222 -0.617 0 CA-C-N 115.533 -0.758 . . . . 0.7 111.577 177.052 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -54.26 -39.16 66.6 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 122.591 0.356 . . . . 1.04 111.032 177.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.462 ' HA ' HD21 ' A' ' 59' ' ' LEU . 2.9 tt0 -79.66 -26.48 41.03 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.667 0.746 . . . . 2.29 110.574 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.412 ' CE1' ' HB2' ' A' ' 102' ' ' ALA . 10.4 m-85 -80.99 -18.41 47.0 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.084 -0.507 . . . . 2.29 112.269 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.662 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 40.1 mt-10 -66.95 -68.49 0.37 Allowed 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 120.603 0.24 . . . . 1.3 110.941 -177.23 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.611 HD23 ' H ' ' A' ' 59' ' ' LEU . 1.9 pt? -48.01 -38.78 17.89 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.529 -0.76 . . . . 1.54 111.242 178.579 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.514 ' N ' ' HG ' ' A' ' 59' ' ' LEU . 66.0 mtt180 -54.67 -53.79 50.16 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.041 -0.527 . . . . 2.58 111.034 -177.457 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -85.25 -21.3 29.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.987 -0.551 . . . . 5.32 110.678 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.783 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 43.5 ttm180 -56.16 -28.5 58.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.12 -0.491 . . . . 4.48 110.889 179.35 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 63' ' ' ARG . 12.5 mmt180 -57.52 -55.6 32.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.77 -0.65 . . . . 4.72 111.297 176.572 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.459 ' HB1' HD13 ' A' ' 68' ' ' LEU . . . -91.84 -32.78 15.2 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.996 0.739 . . . . 1.17 112.996 -173.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.854 ' HA ' ' HB2' ' A' ' 68' ' ' LEU . 0.3 OUTLIER -61.07 -25.44 66.94 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.813 0.671 . . . . 2.81 112.813 -166.566 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.4 m -63.66 -36.07 82.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.292 0.567 . . . . 2.19 110.443 177.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -90.45 -32.41 16.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.493 -0.776 . . . . 2.72 109.926 176.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.854 ' HB2' ' HA ' ' A' ' 65' ' ' PHE . 4.0 mp -64.67 -24.83 67.7 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 115.589 -0.732 . . . . 1.56 112.465 -178.492 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.791 HG22 HG13 ' A' ' 74' ' ' ILE . 2.5 p -61.38 -26.07 67.59 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.498 -0.481 . . . . 0.7 110.731 177.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 29.4 t -72.22 -39.35 68.59 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 109.248 -0.649 . . . . 1.34 109.248 172.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.806 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 33.4 mt-30 -63.62 -52.53 60.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.535 -0.757 . . . . 1.42 110.299 178.534 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.707 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mp -67.5 -31.33 71.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.465 -0.789 . . . . 1.37 110.5 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 64.18 66.22 0.64 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 121.567 0.699 . . . . 2.72 109.464 -173.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.791 HG13 HG22 ' A' ' 69' ' ' THR . 25.3 mm -62.04 117.61 3.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.648 -1.16 . . . . 0.91 110.426 178.341 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.745 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -159.57 -172.52 0.33 Allowed Pre-proline 0 C--N 1.316 -0.881 0 N-CA-C 107.723 -1.214 . . . . 0.51 107.723 -169.481 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.745 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 38.2 Cg_exo -29.79 166.32 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.959 3.773 . . . . 0.47 114.996 164.056 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.449 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.03 -29.3 0.01 OUTLIER Glycine 0 N--CA 1.475 1.279 0 N-CA-C 117.211 1.644 . . . . 0.4 117.211 -175.033 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.448 ' N ' ' O ' ' A' ' 76' ' ' PRO . 23.9 p -67.71 1.23 2.6 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.949 0.874 . . . . 0.56 112.358 178.665 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.401 ' HB2' ' H ' ' A' ' 75' ' ' THR . . . -72.3 -13.93 61.62 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.101 0.476 . . . . 0.34 110.125 171.343 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.441 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 53.5 t80 -75.28 -22.41 57.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.892 -0.595 . . . . 4.13 109.581 175.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -82.7 -27.53 31.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.745 0.783 . . . . 1.03 109.608 174.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.496 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 6.5 m -69.91 -52.48 24.27 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.627 -1.17 . . . . 0.48 109.515 172.096 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -66.47 -23.19 66.23 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.098 -0.955 . . . . 1.18 110.088 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.526 ' HA ' HG23 ' A' ' 87' ' ' VAL . 30.1 tt0 -55.45 -48.7 74.08 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.159 0.504 . . . . 0.8 110.739 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -47.12 -29.78 2.44 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.528 -1.214 . . . . 1.62 111.748 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.673 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.0 t -90.35 -49.77 13.42 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.131 0 CA-C-N 115.121 -0.945 . . . . 1.3 110.199 -173.316 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.526 HG23 ' HA ' ' A' ' 84' ' ' GLU . 0.2 OUTLIER -52.45 -38.69 26.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 122.689 1.233 . . . . 0.85 108.878 177.129 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.452 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 4.4 m-80 -62.65 -43.89 97.65 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 112.652 -2.067 . . . . 0.91 112.16 -177.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 1.034 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.3 pp20? -67.71 -34.51 77.02 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 122.092 0.949 . . . . 2.87 108.967 177.248 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.612 HD13 ' OE2' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -66.9 -24.9 66.16 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-N 113.135 -1.848 . . . . 1.28 111.399 -165.729 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.783 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 4.7 p90 -108.49 -35.56 6.45 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 120.329 -0.548 . . . . 2.3 111.912 -172.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.452 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 10.3 ptm180 -75.31 -35.21 61.27 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.685 0.755 . . . . 5.06 110.675 -171.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.428 ' HB3' HH12 ' A' ' 99' ' ' ARG . 13.6 t70 -87.59 4.27 44.38 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.827 -1.079 . . . . 3.12 112.412 -169.431 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 129.67 70.13 0.12 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 117.375 -2.345 . . . . 2.31 115.505 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.783 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 64.5 t -69.94 99.22 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-O 122.613 1.197 . . . . 1.06 110.93 -179.168 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.584 ' OD1' ' HG2' ' A' ' 99' ' ' ARG . 5.3 p30 -107.45 -179.03 3.8 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 113.402 -1.726 . . . . 2.12 107.726 168.033 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.61 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 15.2 m-90 -49.7 -40.87 41.83 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 123.36 0.412 . . . . 3.34 111.569 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -64.76 -41.01 97.8 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 114.574 0.59 . . . . 0.69 114.574 -175.224 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.584 ' HG2' ' OD1' ' A' ' 96' ' ' ASN . 13.9 mmt85 -58.79 -43.27 90.42 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.21 0.529 . . . . 4.24 111.123 -175.333 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 70.3 mt -68.89 -41.0 81.87 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.533 -0.758 . . . . 0.44 110.622 -176.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 97' ' ' TRP . 63.0 t -54.45 -54.58 20.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.024 -0.535 . . . . 1.35 109.856 171.308 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.412 ' HB2' ' CE1' ' A' ' 57' ' ' PHE . . . -52.33 -45.78 65.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.015 -0.993 . . . . 0.44 111.384 177.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.618 ' HZ ' ' HA ' ' A' ' 130' ' ' MET . 42.5 t80 -55.21 -39.63 69.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.749 . . . . 1.49 111.25 178.359 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 1.004 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 27.0 m-85 -78.47 -35.69 46.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.683 0.278 . . . . 3.29 111.116 177.457 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.74 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 23.1 m -63.69 -47.47 81.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.241 -0.436 . . . . 1.19 110.658 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.437 ' HE1' ' HB2' ' A' ' 65' ' ' PHE . 50.1 t80 -81.74 -29.29 32.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.022 -0.536 . . . . 2.89 110.618 -178.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.46 -47.72 61.3 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.769 -0.729 . . . . 0.3 111.285 175.185 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.952 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -64.92 -28.59 73.66 Favored Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 111.466 -0.654 . . . . 0.23 111.466 176.137 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.1 -32.75 61.51 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.295 -0.261 . . . . 0.31 110.295 176.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.402 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -68.29 -36.25 79.08 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-O 121.896 0.855 . . . . 1.12 109.494 -179.01 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.702 ' SG ' HG13 ' A' ' 123' ' ' VAL . 24.5 t -49.34 -50.88 37.8 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 113.77 -1.559 . . . . 0.26 109.579 171.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.526 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 96.4 t -67.27 -34.43 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 115.634 -0.712 . . . . 0.35 110.945 177.462 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.624 ' HB3' HG21 ' A' ' 74' ' ' ILE . 7.8 mm-40 -59.87 -28.98 68.0 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.388 0.614 . . . . 2.51 110.5 177.03 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.511 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 18.3 m -78.89 -39.61 34.53 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.347 -0.842 . . . . 0.28 109.082 177.085 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.648 HG23 ' O ' ' A' ' 111' ' ' CYS . 96.4 t -67.37 -34.66 70.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.985 0.898 . . . . 1.23 109.634 -177.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -54.78 -50.79 67.62 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.584 -1.644 . . . . 0.6 111.25 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 24.6 mmtt -86.33 12.75 9.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.717 -0.674 . . . . 1.62 110.055 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.39 52.07 4.98 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.87 0.843 . . . . 1.88 110.971 -178.419 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.558 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 25.9 mtm -125.74 44.52 2.81 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.394 -1.276 . . . . 0.31 107.883 178.401 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.46 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 1.6 mt-30 -60.02 -8.13 2.17 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.763 1.023 . . . . 1.15 113.763 -173.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.505 HG23 HD22 ' A' ' 122' ' ' LEU . 27.1 m -66.81 -24.5 32.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 O-C-N 122.008 -0.432 . . . . 0.46 110.904 175.394 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.789 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -71.3 -26.85 63.04 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 116.434 -0.348 . . . . 0.26 110.338 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.702 HG13 ' SG ' ' A' ' 111' ' ' CYS . 69.1 t -46.86 -54.64 2.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 123.576 0.548 . . . . 0.25 111.64 178.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.581 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 2.5 t -70.79 -29.57 65.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.738 0.304 . . . . 1.35 110.757 -179.161 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.789 ' HD2' HD13 ' A' ' 122' ' ' LEU . 73.8 mtt180 -69.31 -54.37 14.93 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.029 0.442 . . . . 2.67 110.436 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.595 HG22 ' SD ' ' A' ' 130' ' ' MET . 73.0 mt -56.01 -52.02 54.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.618 -0.719 . . . . 0.23 110.451 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.816 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.02 -33.73 69.27 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 120.889 0.376 . . . . 0.29 111.599 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.561 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -62.21 -62.31 1.86 Allowed 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 121.124 0.488 . . . . 0.28 110.379 176.283 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -62.07 -32.95 73.54 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.05 -0.977 . . . . 3.91 111.617 -175.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.618 ' HA ' ' HZ ' ' A' ' 103' ' ' PHE . 88.9 mtp -61.63 -53.57 54.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.981 0.419 . . . . 1.08 110.837 178.512 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.523 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -63.82 -39.07 93.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.046 -0.524 . . . . 0.25 110.982 179.399 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 86.3 m -63.66 -47.49 81.06 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.454 -0.339 . . . . 0.4 111.074 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.425 ' CE2' HG12 ' A' ' 87' ' ' VAL . 52.2 t80 -57.21 -39.69 75.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.506 -0.315 . . . . 3.13 110.403 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 1.004 HD12 ' HZ ' ' A' ' 104' ' ' PHE . 4.8 tt -58.32 -54.26 49.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.365 -0.976 . . . . 0.95 108.365 172.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -52.73 -46.31 67.35 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.229 -0.896 . . . . 0.46 112.194 -177.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -80.13 -59.19 2.81 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.319 0.58 . . . . 0.59 111.509 -176.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -92.62 -47.44 7.1 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 113.354 0.872 . . . . 1.45 113.354 -168.329 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.968 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -80.25 -43.35 21.52 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 113.502 0.927 . . . . 1.2 113.502 -166.636 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.665 ' HA ' HD12 ' A' ' 142' ' ' ILE . 32.9 tt0 -45.27 -53.11 18.65 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 112.919 0.711 . . . . 0.75 112.919 -175.101 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.54 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 19.6 Cg_endo -58.62 -45.29 30.66 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.693 1.595 . . . . 0.56 111.718 178.267 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -61.5 -42.58 99.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.419 -0.809 . . . . 1.2 110.547 178.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.665 HD12 ' HA ' ' A' ' 139' ' ' GLU . 28.1 mt -52.11 -49.16 40.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.876 -0.602 . . . . 0.32 110.83 174.42 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.621 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 71.1 mm-40 -63.06 -25.86 68.57 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.547 -0.751 . . . . 0.57 111.324 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.54 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.6 mm-40 -68.15 -22.27 64.86 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.447 0.641 . . . . 0.78 110.0 174.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' ASN . . . . . 0.462 HD22 ' HA ' ' A' ' 96' ' ' ASN . 2.2 m-20 -105.03 4.08 31.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.149 -0.932 . . . . 0.93 109.785 -174.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 111.41 -43.28 1.75 Allowed Glycine 0 N--CA 1.442 -0.935 0 CA-C-N 115.385 -0.825 . . . . 0.56 112.437 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' GLY . . . . . 0.58 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 128.6 -176.88 18.08 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.368 -0.92 . . . . 0.49 112.808 178.284 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.631 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 8.5 m-90 -70.76 -38.48 73.46 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 122.683 0.393 . . . . 3.57 110.843 -178.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -61.35 -45.05 96.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.938 0.399 . . . . 1.96 110.197 178.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.545 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 93.4 m -59.13 -35.41 73.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.853 -0.612 . . . . 0.67 111.477 178.037 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.61 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 88.4 t80 -60.96 -42.01 97.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.802 0.335 . . . . 3.0 110.509 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.475 HG21 ' HB1' ' A' ' 45' ' ' ALA . 1.6 m -71.59 -25.09 24.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 1.15 110.27 179.037 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.487 ' HB2' ' O ' ' A' ' 150' ' ' THR . 19.2 mm-40 -62.19 -30.36 71.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.88 0.371 . . . . 1.67 110.33 171.409 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.7 mt -90.52 -62.05 1.54 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.135 -0.484 . . . . 1.3 110.941 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -123.64 29.65 6.5 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.451 0.643 . . . . 4.24 110.721 -175.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.54 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -58.16 165.81 7.03 Favored Glycine 0 CA--C 1.499 -0.917 0 CA-C-N 115.474 -0.785 . . . . 1.1 113.759 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.486 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 6.7 t30 . . . . . 0 C--N 1.307 -1.26 0 CA-C-N 113.888 -1.156 . . . . 1.29 110.837 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1005 ' ' GLY . . . . . 0.939 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.526 0.721 0 CA-C-O 120.99 0.216 . . . . 1.2 113.293 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1006 ' ' ARG . . . . . 0.833 ' HD3' ' H ' ' B' 1007 ' ' ALA . 0.0 OUTLIER -145.79 -29.56 0.42 Allowed 'General case' 0 C--O 1.215 -0.746 0 C-N-CA 122.787 0.435 . . . . 2.88 110.344 175.888 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B 1007 ' ' ALA . . . . . 0.833 ' H ' ' HD3' ' B' 1006 ' ' ARG . . . -120.33 -27.3 5.26 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-N 115.984 -0.553 . . . . 1.31 110.708 -176.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.422 ' HG ' HG13 ' A' ' 86' ' ' VAL . 2.7 mm? -61.02 -46.77 89.39 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 106.069 -1.826 . . . . 1.33 106.069 165.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B 1009 ' ' ALA . . . . . 1.034 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -53.97 -56.9 13.53 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 113.629 -1.623 . . . . 0.88 111.832 167.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B 1010 ' ' ALA . . . . . 0.775 ' HB3' ' HA ' ' B' 1007 ' ' ALA . . . -67.44 -54.33 21.2 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.165 -0.925 . . . . 1.03 112.908 -171.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 5.7 m-30 -66.0 -26.69 67.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.311 -0.404 . . . . 1.67 110.131 -176.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -87.5 1.01 85.64 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.662 -0.699 . . . . 0.78 113.458 -176.346 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 4.1 t70 -89.48 -3.21 58.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.162 0.506 . . . . 1.9 110.246 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 3.2 m . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 115.949 -0.568 . . . . 1.44 110.357 -179.488 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.1 mp0 . . . . . 0 CA--C 1.522 -0.125 0 CA-C-O 121.349 0.595 . . . . 2.42 109.601 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.518 ' O ' HD13 ' A' ' 8' ' ' LEU . 1.5 p -68.66 -22.71 64.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.509 -0.769 . . . . 1.25 111.554 -178.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.517 ' HB3' HD22 ' A' ' 134' ' ' LEU . 3.1 p30 -62.72 -24.17 67.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.103 -0.499 . . . . 1.78 110.404 175.057 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.534 ' O ' HG23 ' A' ' 10' ' ' VAL . 3.9 tpp180 -61.53 -44.64 96.69 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.766 -0.652 . . . . 1.4 109.832 174.01 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.435 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 42.6 mt-10 -56.1 -57.85 10.4 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 115.554 -0.748 . . . . 0.68 110.166 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.518 HD13 ' O ' ' A' ' 4' ' ' SER . 5.8 mp -41.53 -50.25 4.01 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.647 -1.161 . . . . 1.16 111.098 178.035 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.472 HG21 ' N ' ' A' ' 131' ' ' ALA . 79.0 t -64.66 -59.5 4.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.51 -0.313 . . . . 0.27 111.04 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 6' ' ' ARG . 85.4 t -54.13 -48.14 65.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.135 -0.484 . . . . 0.33 112.122 -175.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -51.09 -43.83 61.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.93 -0.577 . . . . 0.59 110.808 -177.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.642 ' HB2' ' CE2' ' A' ' 104' ' ' PHE . 6.1 t80 -81.59 -41.34 21.69 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.19 -0.459 . . . . 1.61 111.679 -175.118 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 1.028 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 3.8 mp -60.46 -40.21 90.39 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 119.771 -0.772 . . . . 0.34 109.745 178.124 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.495 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 48.5 t -64.07 -46.5 84.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.673 -0.694 . . . . 1.05 110.067 175.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -60.36 -32.22 71.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.518 -0.764 . . . . 1.22 110.9 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.704 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 6.4 mmpt? -75.61 -33.19 60.51 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 111.839 0.311 . . . . 1.41 111.839 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.606 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -62.22 -27.72 69.19 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.736 -0.786 . . . . 1.35 109.788 175.163 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.9 t -65.61 -30.33 71.04 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.379 -0.828 . . . . 0.94 112.219 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.704 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 13.4 pt20 -74.92 -9.24 58.36 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.773 0.657 . . . . 1.37 112.773 -172.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.785 ' NZ ' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -119.24 -19.94 8.14 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 121.918 0.866 . . . . 2.2 109.549 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.51 26.4 6.89 Favored Glycine 0 C--N 1.306 -1.086 0 CA-C-N 113.945 -1.48 . . . . 0.53 113.058 173.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -104.98 171.23 7.43 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.612 0.244 . . . . 0.76 110.555 170.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.6 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 8.3 t -110.67 157.63 19.51 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.104 0.478 . . . . 0.52 110.861 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.534 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 65.6 t-105 -75.92 -52.05 11.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.516 -0.766 . . . . 3.36 110.172 174.041 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m -67.21 -19.91 65.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.579 -0.737 . . . . 1.37 111.685 -174.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.6 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 51.3 mt-30 -51.93 -38.7 57.36 Favored 'General case' 0 N--CA 1.461 0.092 0 N-CA-C 111.793 0.294 . . . . 1.11 111.793 177.791 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -121.93 -4.15 9.11 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.831 0.678 . . . . 1.28 112.831 -178.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.638 ' HB3' HG22 ' A' ' 30' ' ' VAL . 19.8 m -102.16 149.23 24.49 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 122.026 0.917 . . . . 1.81 112.094 -178.062 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -124.37 -1.71 8.09 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 113.594 -1.639 . . . . 2.31 109.015 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.863 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.6 m -58.75 -73.7 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 113.889 -1.505 . . . . 0.92 112.801 -168.29 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.863 ' H ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -90.73 0.06 57.54 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.481 0.658 . . . . 2.74 109.868 177.262 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 . . . . . 0 N--CA 1.447 -0.586 0 CA-C-N 114.774 -1.103 . . . . 1.45 110.857 179.339 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.699 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.308 0 N-CA-C 110.28 -0.267 . . . . 1.12 110.28 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.699 ' H ' HG23 ' A' ' 41' ' ' THR . 14.3 pt-20 -93.85 -31.24 14.42 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.011 0.91 . . . . 2.02 109.892 173.29 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.747 ' HA ' HG13 ' A' ' 46' ' ' VAL . 57.7 m -63.66 -25.11 68.07 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 113.653 -1.612 . . . . 1.25 113.261 -170.85 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -40.12 -50.8 2.65 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 123.613 0.571 . . . . 1.91 112.314 -173.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.82 -40.05 41.75 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.931 -0.308 . . . . 0.52 111.652 176.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.747 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.9 m -65.12 -46.13 92.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 121.284 -0.166 . . . . 1.41 111.381 -176.664 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.744 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.8 ptpt -68.34 -40.27 81.64 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.457 -0.571 . . . . 0.67 109.457 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.48 ' OE1' ' HD2' ' A' ' 51' ' ' ARG . 8.0 mm-40 -58.34 -38.4 77.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.414 -0.812 . . . . 0.99 111.086 174.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.5 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -72.06 -41.57 67.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.4 0.619 . . . . 0.42 110.981 176.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.546 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.1 tp -65.98 -24.83 66.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.318 -0.856 . . . . 1.33 112.087 -174.083 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.505 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 7.6 ptp180 -85.63 -25.91 26.34 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 121.705 0.764 . . . . 2.17 109.491 -177.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.821 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 7.5 mm-40 -69.57 -47.54 63.26 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.705 -1.134 . . . . 1.1 109.282 173.025 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' A' ' 56' ' ' GLU . . . -66.81 -33.19 75.07 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.084 -0.962 . . . . 0.53 110.173 174.506 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.655 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -59.06 -46.44 93.74 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.371 -0.692 . . . . 0.7 111.371 176.761 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.652 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 30.4 t70 -63.26 -37.29 86.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.963 0.411 . . . . 1.04 110.283 176.792 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.485 ' O ' HD11 ' A' ' 59' ' ' LEU . 14.6 tp10 -60.48 -28.15 68.12 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.34 -0.845 . . . . 2.29 110.469 176.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.693 ' HZ ' ' HB3' ' B' 1008 ' ' LEU . 49.8 t80 -81.9 -46.56 13.9 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.322 -0.854 . . . . 2.29 110.771 174.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.747 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 46.3 mt-10 -60.13 -57.67 11.8 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.504 -0.771 . . . . 1.3 112.76 -170.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.705 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -43.32 -41.47 4.06 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.853 1.057 . . . . 1.54 113.853 -172.851 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.705 ' H ' HD12 ' A' ' 59' ' ' LEU . 72.5 mtt85 -67.81 -45.71 73.96 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.011 0.374 . . . . 2.58 112.011 -175.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.747 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 5.0 p90 -92.42 -3.87 54.59 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.731 -0.213 . . . . 5.32 111.159 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.9 tpp180 -43.36 -49.52 6.94 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.361 0.664 . . . . 4.48 112.578 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -67.21 -13.51 62.03 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.209 0.448 . . . . 4.72 112.209 -175.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.487 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -92.14 -26.6 18.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.842 0.312 . . . . 1.17 111.842 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.613 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 81.3 t80 -48.96 -46.45 43.48 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.078 0.77 . . . . 2.81 113.078 -170.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.8 t -68.03 -40.14 82.96 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.913 0.387 . . . . 2.19 110.896 -175.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -71.2 -39.45 71.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.049 -0.523 . . . . 2.72 111.006 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.487 HD13 ' O ' ' A' ' 64' ' ' ALA . 3.7 mp -64.81 -20.46 66.4 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 113.211 0.819 . . . . 1.56 113.211 -171.121 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.528 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 3.2 p -57.45 -35.49 70.19 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.064 0.847 . . . . 0.7 111.16 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.0 t -71.93 -25.36 61.86 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.54 -0.754 . . . . 1.34 109.528 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.48 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 36.7 mt-30 -83.82 -38.01 21.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.223 -0.898 . . . . 1.42 110.133 -178.524 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.583 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.8 mm? -65.96 -32.99 74.8 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.734 -0.469 . . . . 1.37 109.734 170.294 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.433 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 50.6 m80 68.16 41.77 1.89 Allowed 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.144 -1.058 . . . . 2.72 108.144 -173.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.583 HG12 ' HB2' ' A' ' 72' ' ' LEU . 28.0 mm -50.44 117.15 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 113.322 -1.763 . . . . 0.91 111.931 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.761 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.46 -171.48 0.28 Allowed Pre-proline 0 N--CA 1.441 -0.913 0 N-CA-C 107.43 -1.322 . . . . 0.51 107.43 -173.097 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.761 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.7 Cg_exo -28.86 166.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 125.017 3.811 . . . . 0.47 115.355 164.268 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.527 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -29.09 -28.75 0.01 OUTLIER Glycine 0 N--CA 1.472 1.074 0 N-CA-C 117.937 1.935 . . . . 0.4 117.937 -170.488 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.471 ' N ' ' O ' ' A' ' 76' ' ' PRO . 41.7 p -66.72 5.8 0.57 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 118.31 1.055 . . . . 0.56 112.339 -178.672 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.9 -12.43 61.61 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.975 0.417 . . . . 0.34 110.096 174.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.527 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 10.4 p90 -76.33 -17.3 59.49 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.427 0.632 . . . . 4.13 109.349 174.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.436 ' HB2' ' O ' ' A' ' 78' ' ' THR . 35.7 mt-30 -84.91 -20.02 31.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.101 -0.954 . . . . 1.03 109.698 174.015 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.0 m -82.04 -53.28 6.25 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.531 -1.213 . . . . 0.48 109.667 173.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.551 ' HA ' HG23 ' A' ' 86' ' ' VAL . 78.3 t80 -63.09 -16.68 60.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.326 -0.852 . . . . 1.18 110.111 174.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.526 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.3 tt0 -54.68 -50.23 68.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.205 -0.907 . . . . 0.8 110.374 173.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -49.94 -32.15 14.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.986 -1.006 . . . . 1.62 110.888 177.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.883 HG13 HD12 ' B' 1008 ' ' LEU . 1.8 t -80.93 -53.49 12.31 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-N 114.733 -1.121 . . . . 1.3 110.443 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.526 HG12 ' HA ' ' A' ' 84' ' ' GLU . 8.9 p -60.98 -23.55 30.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.815 0.817 . . . . 0.85 109.337 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.6 m-80 -78.06 -38.87 43.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.338 -1.301 . . . . 0.91 112.089 176.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 1.114 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.0 OUTLIER -73.84 -32.38 63.65 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.343 -0.984 . . . . 2.87 108.343 178.805 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.676 HD13 ' OE1' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -67.61 -44.02 79.06 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.553 -1.203 . . . . 1.28 110.233 -174.059 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.407 ' CD1' ' HA ' ' A' ' 88' ' ' ASN . 0.4 OUTLIER -99.14 10.18 41.96 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.496 -0.774 . . . . 2.3 111.066 -169.802 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.862 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.09 -23.47 66.54 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.108 -0.496 . . . . 5.06 110.542 178.301 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -96.44 -31.11 12.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 122.068 0.937 . . . . 3.12 109.186 169.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.59 ' O ' HG23 ' A' ' 95' ' ' VAL . . . 130.79 -42.1 1.44 Allowed Glycine 0 C--N 1.312 -0.79 0 CA-C-N 113.862 -1.517 . . . . 2.31 113.234 165.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.649 HG21 HD22 ' A' ' 138' ' ' LEU . 1.6 t 168.2 131.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 C-N-CA 125.079 1.352 . . . . 1.06 110.582 157.084 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.643 ' H ' ' CB ' ' A' ' 99' ' ' ARG . 2.0 m120 -111.16 170.07 8.35 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.387 -0.824 . . . . 2.12 109.313 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.554 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 16.9 m-90 -54.76 -58.05 9.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.933 0.396 . . . . 3.34 110.713 175.115 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.435 ' O ' HG13 ' A' ' 101' ' ' VAL . . . -70.2 -13.94 70.79 Favored Glycine 0 CA--C 1.518 0.272 0 CA-C-N 115.93 -0.577 . . . . 0.69 112.689 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.643 ' CB ' ' H ' ' A' ' 96' ' ' ASN . 18.2 tpp180 -69.35 -43.2 74.1 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.078 0.466 . . . . 4.24 110.97 -176.767 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 90.2 mt -64.67 -40.26 88.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.731 -0.668 . . . . 0.44 110.547 -178.452 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.551 ' O ' ' HD1' ' A' ' 104' ' ' PHE . 0.5 OUTLIER -63.97 -38.19 81.76 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 CA-C-N 116.204 -0.453 . . . . 1.35 110.322 175.592 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.1 -46.44 89.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.354 0.597 . . . . 0.44 110.217 176.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -58.22 -50.0 75.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.81 -1.087 . . . . 1.49 111.284 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.642 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -76.49 -20.04 57.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.808 0.337 . . . . 3.29 110.948 -176.32 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.617 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 37.3 t -75.67 -55.98 5.13 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.261 -0.427 . . . . 1.19 110.304 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.431 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 31.4 t80 -66.49 -26.66 67.28 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 109.448 -0.575 . . . . 2.89 109.448 179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.57 ' HA3' ' HE1' ' A' ' 130' ' ' MET . . . -65.11 -38.53 95.42 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 121.09 -0.576 . . . . 0.3 111.735 174.036 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 1.028 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -68.77 -35.4 79.93 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.587 -0.816 . . . . 0.23 111.076 174.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.613 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -67.81 -33.3 74.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.366 -0.417 . . . . 0.31 110.627 176.042 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.447 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -60.93 -37.42 82.25 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 122.221 1.01 . . . . 1.12 108.708 -178.854 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.66 ' HB2' HD23 ' A' ' 13' ' ' LEU . 35.3 t -58.69 -53.74 54.98 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.038 -1.437 . . . . 0.26 110.148 174.481 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.785 HG13 ' NZ ' ' A' ' 20' ' ' LYS . 80.7 t -60.18 -40.79 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 116.619 -0.264 . . . . 0.35 110.914 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.528 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 35.6 mt-10 -54.45 -38.22 66.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.011 0.434 . . . . 2.51 110.611 176.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 48.0 m -74.38 -38.78 63.06 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.491 0.663 . . . . 0.28 109.543 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.646 ' HA ' ' HG2' ' A' ' 120' ' ' GLN . 92.0 t -69.31 -30.31 45.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.114 -0.948 . . . . 1.23 109.783 -177.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.81 -49.79 74.32 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 113.641 -1.618 . . . . 0.6 111.027 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 25.8 mmtt -87.4 11.96 13.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.439 -0.801 . . . . 1.62 110.278 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 61.32 50.9 4.49 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 122.044 0.926 . . . . 1.88 110.556 -178.192 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.608 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 24.3 mtm -125.63 46.91 2.3 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.255 -1.339 . . . . 0.31 107.565 176.58 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.646 ' HG2' ' HA ' ' A' ' 115' ' ' VAL . 27.8 mt-30 -68.44 -5.79 21.19 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.083 -0.962 . . . . 1.15 111.142 -172.472 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.636 HG23 HD22 ' A' ' 122' ' ' LEU . 25.8 m -58.02 -24.65 24.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 122.142 -0.349 . . . . 0.46 110.895 172.286 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.704 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.0 mm? -76.06 -26.8 56.9 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.481 -0.327 . . . . 0.26 110.391 178.47 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.615 HG22 ' SG ' ' A' ' 111' ' ' CYS . 78.8 t -45.63 -57.62 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 O-C-N 123.806 0.691 . . . . 0.25 111.707 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -21.45 57.62 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.787 -0.642 . . . . 1.35 111.639 -176.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.704 ' HD2' HD13 ' A' ' 122' ' ' LEU . 86.7 mtt180 -72.35 -58.22 3.57 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.924 -0.58 . . . . 2.67 110.385 175.654 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.636 ' HA ' ' CE2' ' A' ' 129' ' ' TRP . 86.9 mt -48.25 -49.41 12.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.426 -0.806 . . . . 0.23 111.595 -176.365 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.534 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -59.64 -26.3 65.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.09 0.404 . . . . 0.29 112.09 -177.827 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.18 -65.13 0.71 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.496 0.665 . . . . 0.28 110.046 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.636 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 38.7 p-90 -75.16 -17.85 60.31 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.04 -0.982 . . . . 3.91 111.747 -175.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.57 ' HE1' ' HA3' ' A' ' 107' ' ' GLY . 13.3 mmm -62.21 -57.67 10.59 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 120.967 0.413 . . . . 1.08 110.248 170.399 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.472 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -64.0 -38.29 90.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.883 -0.598 . . . . 0.25 110.538 179.014 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.516 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 89.1 m -60.78 -43.56 97.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.399 -0.364 . . . . 0.4 111.534 176.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -60.88 -39.9 90.99 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.775 -0.454 . . . . 3.13 109.775 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.517 HD22 ' HB3' ' A' ' 5' ' ' ASN . 5.4 tt -62.18 -50.87 70.1 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.603 -0.888 . . . . 0.95 108.603 173.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -48.69 -56.74 7.69 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.977 -0.556 . . . . 0.46 112.41 179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -78.06 -49.74 13.4 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.043 0.449 . . . . 0.59 111.88 -174.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -91.3 -50.81 5.61 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 112.788 0.662 . . . . 1.45 112.788 -169.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.649 HD22 HG21 ' A' ' 95' ' ' VAL . 53.7 mt -86.29 -34.68 20.28 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 112.729 0.64 . . . . 1.2 112.729 -166.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.627 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 21.0 tt0 -49.84 -51.39 61.09 Favored Pre-proline 0 CA--C 1.539 0.545 0 O-C-N 123.198 0.311 . . . . 0.75 111.707 -174.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.589 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 24.6 Cg_exo -63.42 -43.3 18.32 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 121.934 1.756 . . . . 0.56 111.951 176.87 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 5.6 t-105 -59.45 -47.35 85.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.418 -0.81 . . . . 1.2 110.223 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.579 HG22 ' HA2' ' A' ' 147' ' ' GLY . 37.4 mt -48.39 -51.58 10.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.592 -0.731 . . . . 0.32 111.095 174.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.627 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 70.1 mm-40 -57.15 -35.25 69.29 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.718 -0.673 . . . . 0.57 111.303 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 9.5 mm-40 -64.8 -21.54 66.8 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.437 0.637 . . . . 0.78 111.307 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' ASN . . . . . 0.41 ' HB3' ' NE1' ' A' ' 97' ' ' TRP . 16.2 m-80 -110.65 9.21 22.91 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.256 -0.884 . . . . 0.93 110.105 -174.372 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 116.43 -47.52 1.03 Allowed Glycine 0 N--CA 1.441 -1.029 0 CA-C-N 114.78 -1.1 . . . . 0.56 112.704 174.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' GLY . . . . . 0.579 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 132.01 -177.24 18.82 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.761 -0.733 . . . . 0.49 111.961 -177.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.608 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 13.6 m-90 -71.01 -37.95 72.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.019 0.438 . . . . 3.57 110.258 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.605 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 6.2 m-20 -64.07 -31.49 72.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.638 -0.71 . . . . 1.96 110.339 178.111 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.593 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 87.0 m -67.34 -40.04 85.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.068 -0.515 . . . . 0.67 111.508 179.348 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.554 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 85.3 t80 -64.72 -31.06 72.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.797 0.808 . . . . 3.0 109.104 -178.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.605 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 87.4 t -59.67 -50.24 80.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 114.422 -1.263 . . . . 1.15 110.35 172.149 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.79 -28.45 64.01 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.829 -1.078 . . . . 1.67 111.518 176.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 150' ' ' THR . 10.2 mt -86.37 -56.13 3.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.458 -0.337 . . . . 1.3 111.26 -177.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -115.11 -44.25 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.871 -0.332 . . . . 4.24 110.461 -178.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.5 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . 50.86 -160.17 1.61 Allowed Glycine 0 CA--C 1.509 -0.343 0 CA-C-O 121.813 0.674 . . . . 1.1 114.597 178.627 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.821 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 6.0 t30 . . . . . 0 N--CA 1.433 -1.289 0 CA-C-N 114.37 -0.915 . . . . 1.29 110.197 -177.308 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1005 ' ' GLY . . . . . 0.401 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.53 0.998 0 N-CA-C 114.026 0.371 . . . . 1.2 114.026 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1006 ' ' ARG . . . . . 0.448 ' HA ' ' HD3' ' B' 1006 ' ' ARG . 26.2 mmt180 -102.63 -48.5 4.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.951 0.405 . . . . 2.88 111.125 174.464 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -63.23 -53.88 46.06 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.913 0.709 . . . . 1.31 112.913 -169.463 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.883 HD12 HG13 ' A' ' 86' ' ' VAL . 3.1 mt -72.55 -40.41 66.72 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.335 -0.617 . . . . 1.33 109.335 -171.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B 1009 ' ' ALA . . . . . 1.114 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -47.73 -49.97 26.63 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 122.212 1.006 . . . . 0.88 109.92 169.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -69.14 -49.42 57.09 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 113.82 -1.537 . . . . 1.03 111.997 -175.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -68.4 -23.76 64.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.238 -0.437 . . . . 1.67 111.161 -176.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -68.18 -23.81 74.72 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 116.062 -0.517 . . . . 0.78 113.639 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.62 -2.87 12.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.274 0.472 . . . . 1.9 112.274 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 32.8 m . . . . . 0 C--N 1.327 -0.406 0 N-CA-C 111.901 0.334 . . . . 1.44 111.901 -178.728 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 . . . . . 0 C--O 1.232 0.181 0 CA-C-O 121.579 0.704 . . . . 2.42 109.707 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.434 ' HB3' ' OG ' ' A' ' 43' ' ' SER . 1.4 m -64.64 -26.47 68.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.071 -0.968 . . . . 1.25 112.208 -174.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.619 ' HB2' HD13 ' A' ' 134' ' ' LEU . 5.2 p30 -66.39 -28.56 68.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.674 0.274 . . . . 1.78 111.483 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.588 ' O ' HG23 ' A' ' 10' ' ' VAL . 7.2 tpp180 -56.99 -46.14 82.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.021 -0.536 . . . . 1.4 110.113 177.478 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.498 ' OE1' ' HB2' ' A' ' 43' ' ' SER . 44.1 mt-10 -55.18 -49.71 71.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.123 -0.944 . . . . 0.68 111.367 -178.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.519 HD21 ' CB ' ' A' ' 43' ' ' SER . 9.0 mt -58.7 -35.83 73.27 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.936 -1.029 . . . . 1.16 110.271 -173.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.481 HG11 ' O ' ' A' ' 127' ' ' ALA . 75.8 t -70.97 -58.94 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.558 -0.747 . . . . 0.27 109.985 174.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 6' ' ' ARG . 86.5 t -52.88 -55.62 11.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.864 -1.062 . . . . 0.33 112.243 -174.886 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.42 -36.35 71.24 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.142 -0.481 . . . . 0.59 110.385 -177.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.689 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 5.7 t80 -70.45 -49.38 49.24 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.847 -0.615 . . . . 1.61 110.573 -178.49 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.993 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.0 mp -62.11 -38.64 89.66 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 120.558 -0.457 . . . . 0.34 110.489 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.433 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 28.6 t -55.65 -46.34 77.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.883 -0.599 . . . . 1.05 110.403 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.411 ' HD2' ' HZ1' ' A' ' 16' ' ' LYS . 38.6 t80 -69.04 -29.07 67.14 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.896 -0.593 . . . . 1.22 110.85 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.636 ' HG2' ' O ' ' A' ' 12' ' ' PHE . 10.0 mmpt? -71.71 -37.42 70.66 Favored 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 121.057 -0.257 . . . . 1.41 110.709 -179.06 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.487 HD21 ' SG ' ' A' ' 111' ' ' CYS . 0.2 OUTLIER -66.64 -30.73 71.06 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.943 -0.391 . . . . 1.35 109.943 174.761 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.0 t -64.05 -25.55 68.16 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.978 -0.556 . . . . 0.94 111.451 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -72.68 -18.53 61.54 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.863 0.84 . . . . 1.37 110.095 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.54 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 19.0 mmmt -104.83 -26.36 12.26 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.249 -1.341 . . . . 2.2 109.281 -175.595 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.35 26.53 7.7 Favored Glycine 0 N--CA 1.438 -1.193 0 CA-C-N 113.815 -1.539 . . . . 0.53 111.433 178.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.666 ' HB3' ' HE2' ' A' ' 27' ' ' PHE . 96.0 m-85 -115.46 166.82 11.46 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.335 -0.432 . . . . 0.76 110.298 177.593 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.9 t -110.8 145.76 37.59 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.274 -0.421 . . . . 0.52 110.632 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 1.7 t90 -68.88 -49.99 53.52 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.248 -0.433 . . . . 3.36 109.897 174.42 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.8 p -61.77 -37.46 84.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.642 -0.708 . . . . 1.37 111.45 -173.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -58.88 -28.75 66.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.209 -0.451 . . . . 1.11 111.477 178.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.666 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 17.4 m-85 -117.04 16.31 15.04 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.035 0.445 . . . . 1.28 110.726 -175.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.61 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 78.9 p -100.46 179.52 4.42 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.4 0.619 . . . . 1.81 111.814 -174.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.611 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 14.3 t70 -167.05 -13.17 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.399 -1.273 . . . . 2.31 108.515 -178.405 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.931 HG23 ' H ' ' A' ' 31' ' ' GLU . 9.0 m -67.48 -72.0 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.232 -1.349 . . . . 0.92 111.707 179.085 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.931 ' H ' HG23 ' A' ' 30' ' ' VAL . 28.4 mm-40 -94.48 2.54 55.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.846 -0.798 . . . . 2.74 108.846 177.091 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.611 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 6.2 tt0 . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 114.8 -1.091 . . . . 1.45 111.084 -177.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.884 HG23 ' H ' ' A' ' 42' ' ' GLU . 2.6 t . . . . . 0 N--CA 1.448 -0.525 0 N-CA-C 109.931 -0.396 . . . . 1.12 109.931 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.884 ' H ' HG23 ' A' ' 41' ' ' THR . 14.5 pt-20 -93.32 -31.66 14.59 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.618 1.199 . . . . 2.02 108.631 166.378 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . 1.002 ' HA ' HG13 ' A' ' 46' ' ' VAL . 39.4 m -68.94 -17.21 63.92 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 113.071 -1.877 . . . . 1.25 114.68 -167.599 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -52.82 -39.82 62.76 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 118.439 0.563 . . . . 1.91 111.001 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -82.08 -40.38 22.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.592 -0.276 . . . . 0.52 111.205 176.185 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 1.002 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.8 m -69.43 -36.95 74.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.896 -0.321 . . . . 1.41 111.313 -175.747 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -71.27 -34.94 71.15 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 108.776 -0.824 . . . . 0.67 108.776 178.153 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.596 HE22 ' HD3' ' A' ' 51' ' ' ARG . 4.3 mm100 -64.21 -32.88 74.63 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.161 -0.927 . . . . 0.99 110.42 177.388 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.682 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -77.42 -42.44 36.13 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.886 -0.597 . . . . 0.42 110.779 175.511 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.498 HD12 ' CE2' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -66.51 -23.13 66.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.001 -0.545 . . . . 1.33 112.242 -176.387 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.596 ' HD3' HE22 ' A' ' 48' ' ' GLN . 16.2 ptm180 -78.12 -29.13 48.72 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 107.863 -1.162 . . . . 2.17 107.863 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.946 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 6.6 mm-40 -74.42 -52.13 12.93 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 113.565 -1.652 . . . . 1.1 109.835 177.313 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.07 -44.39 92.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.823 -0.626 . . . . 0.53 111.025 178.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.58 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.86 -36.04 92.84 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 121.045 -0.598 . . . . 0.7 111.984 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -64.33 -37.11 86.34 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 110.34 -0.245 . . . . 1.04 110.34 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.534 ' HA ' HD11 ' A' ' 59' ' ' LEU . 24.3 mm-40 -60.5 -27.06 67.3 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.544 0.528 . . . . 2.29 111.292 177.214 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.579 ' HD2' ' HB3' ' A' ' 105' ' ' SER . 36.8 t80 -80.33 -26.4 38.77 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.986 0.422 . . . . 2.29 110.271 175.307 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.58 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 46.4 mt-10 -67.94 -60.78 2.24 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.933 -0.576 . . . . 1.3 111.951 -174.509 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.612 HD22 ' N ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -55.71 -33.76 64.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 118.18 0.445 . . . . 1.54 110.995 -178.992 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.612 ' N ' HD22 ' A' ' 59' ' ' LEU . 59.7 mtt180 -60.22 -62.65 1.71 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.759 -0.655 . . . . 2.58 112.049 172.333 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -92.71 -2.98 55.58 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.339 0.866 . . . . 5.32 113.339 -168.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.868 ' HA ' ' CE2' ' A' ' 65' ' ' PHE . 32.6 ttt180 -52.81 -45.61 67.31 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.895 0.702 . . . . 4.48 112.895 -171.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -69.56 -14.04 62.64 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.964 -0.294 . . . . 4.72 111.212 -178.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.664 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.35 -60.77 1.84 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.012 0.375 . . . . 1.17 112.012 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.89 ' HA ' HD11 ' A' ' 68' ' ' LEU . 4.9 p90 -57.88 -29.45 65.04 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.751 1.019 . . . . 2.81 113.751 -167.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.3 t -90.74 -11.33 39.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.312 0.577 . . . . 2.19 110.43 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -90.8 -50.97 5.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.779 0.8 . . . . 2.72 110.413 -177.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.984 HD13 HD11 ' A' ' 72' ' ' LEU . 0.4 OUTLIER -67.44 -4.29 10.85 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.357 -1.292 . . . . 1.56 114.4 -174.372 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.803 ' HA ' HD13 ' A' ' 72' ' ' LEU . 3.2 p -45.78 -23.75 0.3 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 118.779 0.718 . . . . 0.7 112.86 -171.515 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 73.7 m -46.48 -60.15 2.53 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.1 0.56 . . . . 1.34 111.508 166.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.454 ' CD ' ' H ' ' A' ' 71' ' ' GLN . 1.1 mp0 -47.79 -51.5 22.27 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 124.441 1.097 . . . . 1.42 111.39 176.27 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.984 HD11 HD13 ' A' ' 68' ' ' LEU . 2.9 mp -77.59 -19.82 54.97 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.236 -1.347 . . . . 1.37 111.339 -166.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.9 t-80 54.54 50.0 17.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.817 0.818 . . . . 2.72 109.103 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.731 HG13 HG22 ' A' ' 69' ' ' THR . 30.9 mm -57.44 105.67 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 114.113 -1.403 . . . . 0.91 111.33 -177.055 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.757 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.91 -169.55 0.22 Allowed Pre-proline 0 C--N 1.315 -0.913 0 N-CA-C 107.022 -1.473 . . . . 0.51 107.022 -169.146 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.757 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 65.9 Cg_exo -28.92 165.38 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 124.674 3.583 . . . . 0.47 115.236 164.296 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.647 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -28.72 -32.67 0.01 OUTLIER Glycine 0 N--CA 1.469 0.834 0 N-CA-C 117.523 1.769 . . . . 0.4 117.523 -171.47 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.443 ' N ' ' O ' ' A' ' 76' ' ' PRO . 37.3 p -64.43 3.67 0.45 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 118.125 0.962 . . . . 0.56 112.618 -176.429 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.1 -14.36 62.96 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.235 0.54 . . . . 0.34 109.608 171.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.647 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 13.3 p90 -72.66 -20.81 61.18 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.791 -0.64 . . . . 4.13 109.44 175.115 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.479 ' O ' ' HG3' ' A' ' 85' ' ' GLN . 57.0 mt-30 -79.08 -30.05 43.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.442 0.639 . . . . 1.03 109.854 177.117 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -70.55 -49.17 50.82 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.9 -1.045 . . . . 0.48 109.263 173.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.491 ' O ' HG13 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -68.72 -16.69 63.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.053 -1.431 . . . . 1.18 110.773 176.264 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.578 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.5 tt0 -70.71 -52.43 21.0 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.086 -0.507 . . . . 0.8 110.809 178.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' A' ' 81' ' ' GLN . 58.4 mt-30 -45.64 -40.53 9.16 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 114.802 -1.09 . . . . 1.62 111.207 -179.018 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.918 ' HA ' ' HA2' ' B' 1005 ' ' GLY . 1.2 p -86.47 -47.71 16.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-N 113.55 -1.659 . . . . 1.3 111.697 -173.096 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.578 HG12 ' HA ' ' A' ' 84' ' ' GLU . 8.1 p -61.95 -24.95 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.882 0.849 . . . . 0.85 109.835 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.451 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 0.6 OUTLIER -62.11 -44.83 95.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.266 -1.334 . . . . 0.91 110.629 178.518 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.844 ' HB3' ' HB2' ' B' 1009 ' ' ALA . 7.9 mm-40 -71.66 -37.92 70.73 Favored 'General case' 0 CA--C 1.495 -1.164 0 CA-C-O 121.719 0.771 . . . . 2.87 109.758 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.514 HD23 ' HD2' ' A' ' 99' ' ' ARG . 16.3 mt -59.78 -19.03 47.95 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 113.781 -1.554 . . . . 1.28 111.884 -172.489 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.654 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 84.9 t80 -105.04 -35.58 7.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.51 0.672 . . . . 2.3 111.489 -177.054 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.451 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 8.4 ptm180 -84.0 -36.41 23.18 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.863 -0.608 . . . . 5.06 111.471 -172.122 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -95.85 21.21 8.83 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.901 -0.59 . . . . 3.12 112.58 -170.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.19 68.41 0.11 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 117.665 -2.207 . . . . 2.31 115.814 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.654 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 60.8 t -74.98 102.1 2.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 118.599 1.2 . . . . 1.06 111.243 174.319 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.419 ' H ' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -111.54 -173.18 2.19 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.547 -1.206 . . . . 2.12 108.402 173.072 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.573 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 7.5 m95 -61.98 -55.31 30.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.707 0.289 . . . . 3.34 111.245 177.092 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.68 -15.46 71.09 Favored Glycine 0 CA--C 1.519 0.314 0 C-N-CA 120.943 -0.646 . . . . 0.69 113.097 -178.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.592 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 20.3 tpp180 -69.82 -43.49 71.91 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.218 0.532 . . . . 4.24 110.622 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.481 ' O ' ' HD1' ' A' ' 104' ' ' PHE . 61.2 mt -68.09 -34.98 69.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.447 -0.797 . . . . 0.44 111.38 -175.036 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -60.74 -29.19 44.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 120.841 0.353 . . . . 1.35 110.774 179.062 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.436 ' O ' ' HD1' ' A' ' 106' ' ' PHE . . . -62.55 -46.93 86.1 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.447 0.641 . . . . 0.44 110.268 177.479 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.619 ' HA ' ' CE1' ' A' ' 106' ' ' PHE . 30.8 t80 -53.43 -37.71 62.82 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.356 -1.293 . . . . 1.49 111.211 177.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.671 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 47.7 m-85 -76.53 -39.47 52.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.298 -0.41 . . . . 3.29 111.116 178.139 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.689 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 22.6 t -63.04 -54.86 31.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.013 -0.54 . . . . 1.19 111.317 -176.578 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.619 ' CE1' ' HA ' ' A' ' 103' ' ' PHE . 3.9 p90 -76.81 -23.51 52.82 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.436 -0.506 . . . . 2.89 110.41 -177.404 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.38 -44.64 73.12 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 110.8 -0.92 . . . . 0.3 110.8 174.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.993 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.32 -31.18 79.64 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.874 -0.679 . . . . 0.23 111.53 175.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -76.0 -28.87 57.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.787 0.327 . . . . 0.31 110.745 176.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.46 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.66 -41.78 98.17 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.083 -1.08 . . . . 1.12 108.083 178.366 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.699 ' SG ' HG22 ' A' ' 123' ' ' VAL . 16.9 t -49.63 -51.66 36.14 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 113.449 -1.705 . . . . 0.26 110.964 172.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.538 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 69.1 t -65.66 -40.94 89.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.346 -0.388 . . . . 0.35 111.924 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.714 ' HB3' HG21 ' A' ' 74' ' ' ILE . 18.3 mm-40 -63.03 -22.85 67.14 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.238 0.542 . . . . 2.51 110.499 178.502 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.488 ' HB3' ' HB2' ' A' ' 122' ' ' LEU . 26.4 m -76.99 -37.76 54.5 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.977 -0.749 . . . . 0.28 108.977 174.318 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' ' 111' ' ' CYS . 98.1 t -66.17 -35.11 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.147 -0.933 . . . . 1.23 109.332 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.512 ' OD2' ' HD3' ' A' ' 117' ' ' LYS . 25.9 t70 -52.0 -51.22 58.76 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 113.48 -1.691 . . . . 0.6 111.597 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.512 ' HD3' ' OD2' ' A' ' 116' ' ' ASP . 12.7 mmtp -85.38 13.78 6.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.017 -0.538 . . . . 1.62 110.282 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 61.79 44.38 8.68 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.715 0.769 . . . . 1.88 110.53 -178.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.494 ' HB3' HD23 ' A' ' 122' ' ' LEU . 25.8 mtm -119.74 44.8 2.3 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 107.871 -1.159 . . . . 0.31 107.871 -179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.459 ' HB3' ' CG ' ' A' ' 27' ' ' PHE . 0.6 OUTLIER -60.4 -7.2 1.9 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.52 -1.218 . . . . 1.15 112.845 -175.913 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.508 HG23 HD22 ' A' ' 122' ' ' LEU . 27.4 m -67.29 -25.14 32.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.628 0.251 . . . . 0.46 111.205 172.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.523 HD13 ' HD3' ' A' ' 125' ' ' ARG . 3.5 mm? -70.93 -29.33 65.34 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 110.161 -0.311 . . . . 0.26 110.161 177.449 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.699 HG22 ' SG ' ' A' ' 111' ' ' CYS . 72.2 t -44.79 -53.57 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 123.841 0.713 . . . . 0.25 111.78 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.61 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 0.0 OUTLIER -70.68 -37.15 73.6 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 116.057 -0.52 . . . . 1.35 111.244 -179.565 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.523 ' HD3' HD13 ' A' ' 122' ' ' LEU . 60.8 mtp180 -62.36 -57.05 12.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 116.142 -0.481 . . . . 2.67 110.502 -179.568 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.581 HG22 ' SD ' ' A' ' 130' ' ' MET . 76.7 mt -52.53 -49.82 42.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.677 -0.692 . . . . 0.23 110.613 -178.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.593 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.96 -36.84 70.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.942 0.401 . . . . 0.29 111.193 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.75 -60.86 2.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.336 0.589 . . . . 0.28 110.397 176.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -60.17 -32.61 71.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.638 -1.165 . . . . 3.91 111.227 -176.427 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.584 ' SD ' HD11 ' A' ' 13' ' ' LEU . 89.2 mtp -63.51 -56.43 16.11 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.954 0.407 . . . . 1.08 110.765 177.25 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.441 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -61.17 -37.03 81.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.27 -0.423 . . . . 0.25 110.545 179.394 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.425 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 98.0 m -63.22 -45.12 93.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.454 -0.339 . . . . 0.4 111.232 177.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -56.45 -40.34 74.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.176 0.512 . . . . 3.13 109.877 177.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 1.001 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.2 tt -65.06 -49.67 69.17 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.313 -0.625 . . . . 0.95 109.313 175.021 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ASN . . . . . 0.425 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 4.7 m-80 -49.91 -49.12 50.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.792 -0.64 . . . . 0.46 111.905 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -81.97 -54.54 5.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.15 -0.477 . . . . 0.59 111.86 -176.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.76 -51.03 5.43 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.283 0.846 . . . . 1.45 113.283 -169.012 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 1.001 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -79.88 -44.18 20.91 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 114.054 1.131 . . . . 1.2 114.054 -165.006 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.622 ' HA ' HD12 ' A' ' 142' ' ' ILE . 37.0 tt0 -47.18 -51.73 39.65 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 112.69 0.626 . . . . 0.75 112.69 -174.338 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.579 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 51.1 Cg_exo -52.75 -50.66 13.29 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 121.962 1.774 . . . . 0.56 111.784 177.69 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 4.2 t-105 -58.44 -50.75 72.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.51 -0.768 . . . . 1.2 110.441 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.622 HD12 ' HA ' ' A' ' 139' ' ' GLU . 54.7 mt -46.43 -53.87 2.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.117 -0.492 . . . . 0.32 111.613 175.163 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.603 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 78.3 mm-40 -59.16 -34.15 71.76 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.689 -0.687 . . . . 0.57 111.723 -178.068 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 67.8 mm-40 -63.3 -25.76 68.46 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.573 0.701 . . . . 0.78 111.029 177.106 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -96.06 -16.67 21.46 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.182 -0.917 . . . . 0.93 109.625 -171.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 142.62 -40.05 1.3 Allowed Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.478 -0.783 . . . . 0.56 112.665 175.253 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' GLY . . . . . 0.542 ' H ' ' HH2' ' A' ' 97' ' ' TRP . . . 120.36 170.62 14.3 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.958 -0.639 . . . . 0.49 111.675 -178.261 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.696 ' HZ2' HD21 ' A' ' 134' ' ' LEU . 6.8 m0 -65.92 -35.09 79.65 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.923 0.342 . . . . 3.57 111.923 -175.37 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.542 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 8.8 m-20 -63.23 -31.08 72.14 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.697 0.284 . . . . 1.96 110.247 177.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.531 ' O ' HD13 ' A' ' 154' ' ' LEU . 72.3 m -70.11 -36.06 74.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.416 -0.356 . . . . 0.67 110.867 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.573 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 91.1 t80 -62.27 -33.45 74.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.787 -0.82 . . . . 3.0 108.787 178.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.542 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 90.8 t -63.88 -52.83 51.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 114.438 -1.255 . . . . 1.15 111.131 174.5 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.517 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 24.0 mm-40 -48.75 -46.99 41.97 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.125 -0.943 . . . . 1.67 111.643 176.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.531 HD13 ' O ' ' A' ' 150' ' ' THR . 8.2 mp -78.17 -60.81 2.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.998 0.74 . . . . 1.3 112.998 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -119.85 27.48 8.67 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.187 -0.46 . . . . 4.24 110.632 -167.247 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.682 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -57.62 165.44 6.44 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 115.619 -0.719 . . . . 1.1 114.336 -179.389 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.946 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 12.7 t30 . . . . . 0 C--N 1.316 -0.888 0 CA-C-N 113.308 -1.446 . . . . 1.29 112.107 -177.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1005 ' ' GLY . . . . . 0.918 ' HA2' ' HA ' ' A' ' 86' ' ' VAL . . . . . . . . 0 N--CA 1.43 -1.702 0 N-CA-C 110.594 -1.002 . . . . 1.2 110.594 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1006 ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' B' 1006 ' ' ARG . 29.4 mmt180 -56.63 -40.31 75.18 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 111.989 0.366 . . . . 2.88 111.989 176.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -66.98 -52.39 43.35 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 120.692 0.282 . . . . 1.31 111.456 -175.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.819 ' HB2' HG23 ' A' ' 86' ' ' VAL . 3.8 mm? -75.14 -37.41 61.39 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.842 0.353 . . . . 1.33 110.872 -174.08 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B 1009 ' ' ALA . . . . . 0.844 ' HB2' ' HB3' ' A' ' 89' ' ' GLU . . . -45.72 -47.54 15.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.743 0.782 . . . . 0.88 110.057 165.495 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -75.56 -60.4 2.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.726 -1.124 . . . . 1.03 112.121 -177.072 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -59.0 -33.25 70.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.945 -0.571 . . . . 1.67 111.829 -176.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -67.2 -20.79 71.5 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.886 -0.673 . . . . 0.78 113.417 -175.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 28.3 t70 -67.56 -20.16 65.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.868 0.334 . . . . 1.9 111.213 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 10.6 m . . . . . 0 C--O 1.227 -0.106 0 CA-C-O 120.901 0.381 . . . . 1.44 110.952 -175.906 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 121.643 0.735 . . . . 2.42 110.008 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 m -69.77 -15.42 63.13 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.02 -0.991 . . . . 1.25 112.351 -176.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.592 ' HB3' HD22 ' A' ' 134' ' ' LEU . 1.1 p30 -61.19 -18.7 59.57 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.092 -0.504 . . . . 1.78 110.848 175.04 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.558 ' O ' HG23 ' A' ' 10' ' ' VAL . 20.0 tpp85 -60.25 -45.5 93.04 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.861 -0.609 . . . . 1.4 109.844 175.021 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -59.56 -52.86 63.72 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.827 -0.624 . . . . 0.68 111.274 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.57 HD22 ' HA ' ' A' ' 5' ' ' ASN . 2.7 mp -45.66 -37.46 5.76 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.223 -0.899 . . . . 1.16 111.47 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 70.0 t -76.81 -62.52 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.055 -0.521 . . . . 0.27 110.659 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 6' ' ' ARG . 86.5 t -52.14 -49.96 37.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.373 -0.831 . . . . 0.33 112.841 -174.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -54.07 -32.64 55.28 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.508 0.505 . . . . 0.59 110.653 -175.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.558 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 55.7 t80 -84.12 -44.64 13.82 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.285 -0.416 . . . . 1.61 111.548 -179.128 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.889 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.7 mp -58.13 -40.5 81.42 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 120.024 -0.67 . . . . 0.34 109.98 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.413 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 23.1 t -60.73 -40.89 94.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.99 -0.55 . . . . 1.05 110.312 176.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -73.51 -25.39 60.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.814 -0.63 . . . . 1.22 111.309 -178.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.716 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.6 OUTLIER -78.52 -50.24 11.95 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-O 121.226 0.536 . . . . 1.41 110.094 -174.637 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.701 HD21 ' SG ' ' A' ' 111' ' ' CYS . 13.2 mt -55.18 -29.78 58.56 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.511 -0.768 . . . . 1.35 111.277 173.565 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.7 t -60.81 -29.02 69.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.47 -0.787 . . . . 0.94 111.908 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.716 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 20.8 pt20 -75.29 -16.72 60.41 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.201 0.524 . . . . 1.37 110.932 -176.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.798 ' HD2' HG22 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -100.66 -23.69 14.59 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 122.197 0.999 . . . . 2.2 108.58 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.01 26.28 7.55 Favored Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 113.651 -1.613 . . . . 0.53 112.468 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.489 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 86.8 m-85 -112.61 166.61 11.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.542 0.21 . . . . 0.76 110.801 176.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.1 t -109.31 151.29 26.79 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.263 -0.426 . . . . 0.52 110.632 -178.259 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.671 ' CH2' ' HB2' ' A' ' 31' ' ' GLU . 3.0 t90 -75.06 -52.9 9.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.073 -0.512 . . . . 3.36 110.356 175.257 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.433 ' HB2' ' CE3' ' A' ' 24' ' ' TRP . 22.6 t -72.45 -18.55 61.68 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.227 -0.442 . . . . 1.37 111.495 -172.162 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -65.53 -22.48 66.72 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.191 -0.604 . . . . 1.11 110.785 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -108.96 -33.75 6.83 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.826 -0.625 . . . . 1.28 110.863 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.701 ' HB3' HG22 ' A' ' 30' ' ' VAL . 10.6 m -101.54 143.84 31.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.71 0.767 . . . . 1.81 112.112 -177.233 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.502 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 15.4 t70 -108.15 -7.4 16.05 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.162 -1.381 . . . . 2.31 109.383 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.843 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.0 m -53.61 -72.97 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 114.067 -1.424 . . . . 0.92 112.915 -170.116 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.843 ' H ' HG23 ' A' ' 30' ' ' VAL . 20.5 mm-40 -91.57 1.5 57.1 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.965 -0.754 . . . . 2.74 108.965 178.251 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.502 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.1 tt0 . . . . . 0 N--CA 1.446 -0.639 0 CA-C-N 114.834 -1.075 . . . . 1.45 110.205 179.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.698 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.3 t . . . . . 0 CA--C 1.541 0.617 0 N-CA-C 110.145 -0.317 . . . . 1.12 110.145 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.698 ' H ' HG23 ' A' ' 41' ' ' THR . 0.0 OUTLIER -92.18 -34.98 14.09 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.551 0.691 . . . . 2.02 109.393 169.095 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.772 ' HA ' HG13 ' A' ' 46' ' ' VAL . 7.3 p -47.95 -39.29 18.89 Favored 'General case' 0 C--O 1.214 -0.794 0 CA-C-N 113.943 -1.481 . . . . 1.25 112.846 -171.343 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -39.4 -51.17 2.11 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 123.946 0.779 . . . . 1.91 111.989 -175.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.418 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -75.72 -42.61 50.29 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 121.186 -0.206 . . . . 0.52 111.414 179.222 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.772 HG13 ' HA ' ' A' ' 43' ' ' SER . 0.5 OUTLIER -68.0 -44.87 84.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 N-CA-C 111.652 0.241 . . . . 1.41 111.652 -175.902 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.769 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.0 ptpt -67.35 -39.3 85.73 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.293 -0.632 . . . . 0.67 109.293 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.491 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 27.1 mm-40 -57.83 -43.83 86.07 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 115.631 -0.713 . . . . 0.99 111.635 174.255 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.588 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -70.46 -34.95 73.0 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.243 0.544 . . . . 0.42 110.42 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.451 ' HG ' ' CE1' ' A' ' 104' ' ' PHE . 4.0 tp -64.84 -28.48 69.58 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.322 -0.854 . . . . 1.33 111.695 -175.449 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.427 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 3.8 ptp85 -86.88 -23.04 25.37 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.271 0.558 . . . . 2.17 110.108 -177.296 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.569 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.3 mm-40 -70.63 -47.42 60.14 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.091 -0.959 . . . . 1.1 109.826 175.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.03 -36.47 75.09 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.736 -0.665 . . . . 0.53 109.438 171.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.63 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -57.9 -44.54 94.37 Favored Glycine 0 C--O 1.219 -0.79 0 CA-C-N 114.995 -1.002 . . . . 0.7 112.276 178.671 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -52.36 -44.59 65.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.906 0.384 . . . . 1.04 111.329 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 41.6 mt-10 -67.47 -29.05 68.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.791 -0.641 . . . . 2.29 111.721 179.344 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.5 ' HE1' ' HA2' ' B' 1012 ' ' GLY . 13.4 m-85 -81.03 -41.96 21.85 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.973 -0.558 . . . . 2.29 111.255 176.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.63 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.0 mt-10 -55.85 -50.02 71.73 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.189 0.519 . . . . 1.3 109.869 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.463 HD12 ' N ' ' A' ' 60' ' ' ARG . 3.8 pp -64.6 -35.05 79.73 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.232 -0.894 . . . . 1.54 110.648 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.463 ' N ' HD12 ' A' ' 59' ' ' LEU . 8.6 ttt180 -70.1 -44.96 67.96 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 120.377 -0.529 . . . . 2.58 111.203 -167.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -90.54 -3.75 57.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.294 -0.412 . . . . 5.32 111.196 -179.41 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.529 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 51.2 ttp180 -50.06 -37.23 32.46 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.174 0.805 . . . . 4.48 113.174 -171.729 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 -66.97 -38.79 86.74 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.985 0.422 . . . . 4.72 110.937 -179.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.666 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.76 -42.82 9.36 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.603 0.964 . . . . 1.17 113.603 -172.413 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.529 ' CD1' ' HA ' ' A' ' 62' ' ' ARG . 8.1 p90 -52.69 -39.13 61.68 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.045 1.128 . . . . 2.81 114.045 -161.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.9 t -85.49 -21.74 28.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.155 0.502 . . . . 2.19 110.066 -175.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -77.46 -31.84 54.07 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.038 -0.727 . . . . 2.72 109.038 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.666 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 61.8 mt -63.46 -15.09 56.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.975 -1.011 . . . . 1.56 112.032 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.777 HG22 HG13 ' A' ' 74' ' ' ILE . 17.5 p -54.36 -37.06 64.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.254 0.55 . . . . 0.7 110.474 -177.158 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 67.2 m -61.71 -31.51 71.66 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.063 -0.971 . . . . 1.34 111.123 176.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.429 ' OE1' HD22 ' A' ' 68' ' ' LEU . 43.2 mt-30 -80.69 -47.69 13.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.603 -0.726 . . . . 1.42 110.224 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.586 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mp -68.1 -31.81 71.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.544 -0.753 . . . . 1.37 110.444 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.442 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 50.4 m-70 68.51 64.06 0.34 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.607 0.718 . . . . 2.72 109.91 -173.213 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.777 HG13 HG22 ' A' ' 69' ' ' THR . 26.0 mm -65.02 108.88 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.477 -1.238 . . . . 0.91 110.594 178.181 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.738 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.83 -171.49 0.27 Allowed Pre-proline 0 C--N 1.316 -0.869 0 N-CA-C 107.45 -1.315 . . . . 0.51 107.45 -169.396 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.738 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.0 Cg_exo -30.91 166.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 124.777 3.652 . . . . 0.47 114.766 164.243 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.489 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.33 -28.87 0.01 OUTLIER Glycine 0 N--CA 1.476 1.353 0 N-CA-C 117.225 1.65 . . . . 0.4 117.225 -173.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.46 ' N ' ' O ' ' A' ' 76' ' ' PRO . 31.2 p -68.87 3.46 1.96 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.838 0.819 . . . . 0.56 112.0 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.02 -14.51 61.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.184 0.516 . . . . 0.34 109.675 170.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.452 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 44.0 t80 -75.54 -22.79 56.75 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.761 -0.654 . . . . 4.13 109.372 174.074 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.445 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 34.0 mt-30 -82.57 -23.9 34.23 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.625 0.726 . . . . 1.03 109.865 174.093 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 13.7 m -72.68 -53.76 10.86 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 114.557 -1.201 . . . . 0.48 109.565 171.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.436 ' HA ' HG23 ' A' ' 86' ' ' VAL . 85.3 t80 -65.79 -17.92 64.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.029 -0.987 . . . . 1.18 110.229 175.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.604 ' HA ' HG12 ' A' ' 87' ' ' VAL . 34.7 tt0 -60.9 -49.34 77.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.884 -0.598 . . . . 0.8 110.389 177.201 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -50.6 -34.31 25.42 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.988 -1.006 . . . . 1.62 110.622 176.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.596 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 1.8 t -80.63 -51.54 15.64 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 114.646 -1.161 . . . . 1.3 110.602 -176.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.604 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.0 p -63.54 -21.75 29.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.826 0.822 . . . . 0.85 109.841 -179.055 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.2 m-80 -78.53 -45.49 21.76 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.367 -1.288 . . . . 0.91 111.615 175.28 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 1.028 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 16.2 pt-20 -69.57 -32.3 70.98 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 107.961 -1.125 . . . . 2.87 107.961 -178.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.596 ' HB2' ' O ' ' A' ' 86' ' ' VAL . 0.2 OUTLIER -60.61 -31.06 70.25 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 113.182 -1.827 . . . . 1.28 111.152 177.983 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.677 ' HA ' HG22 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -99.27 -38.29 8.93 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.07 0.462 . . . . 2.3 111.29 -169.533 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.56 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 10.3 ptm180 -72.65 -34.22 67.11 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.652 -0.704 . . . . 5.06 110.586 -174.32 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -89.13 8.63 29.02 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.851 -1.068 . . . . 3.12 112.31 -172.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.68 72.52 0.11 Allowed Glycine 0 C--N 1.337 0.618 0 C-N-CA 117.01 -2.519 . . . . 2.31 116.15 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.874 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 48.8 t -71.1 92.62 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 CA-C-N 119.053 1.427 . . . . 1.06 111.361 177.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -114.65 -170.81 1.81 Allowed 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.493 -1.23 . . . . 2.12 108.854 178.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.843 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 13.4 m-90 -58.84 -38.0 77.72 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.064 0.459 . . . . 3.34 110.865 177.484 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.553 ' O ' ' HB ' ' A' ' 101' ' ' VAL . . . -83.47 -32.19 25.66 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.91 -0.662 . . . . 0.69 114.536 -170.15 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.874 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 0.6 OUTLIER -69.1 -30.08 68.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 118.078 0.939 . . . . 4.24 109.587 -176.935 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 82.2 mt -69.81 -34.19 59.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.4 0.619 . . . . 0.44 109.53 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.553 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 79.5 t -55.03 -58.66 3.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 114.935 -1.029 . . . . 1.35 110.045 168.091 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -51.39 -41.74 60.92 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.773 -0.649 . . . . 0.44 110.873 176.369 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -59.78 -54.3 47.9 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.441 -0.799 . . . . 1.49 112.02 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.496 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.4 OUTLIER -72.76 -23.53 60.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.035 0.445 . . . . 3.29 110.435 -176.44 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.558 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 13.3 t -76.32 -53.88 7.57 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.794 -0.639 . . . . 1.19 110.521 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -66.9 -28.07 68.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.009 0.433 . . . . 2.89 109.911 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.487 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -65.72 -44.09 93.0 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.79 -0.641 . . . . 0.3 111.71 174.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.889 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.79 -35.27 91.8 Favored Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.461 -0.876 . . . . 0.23 111.222 175.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.73 -28.91 65.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.556 -0.322 . . . . 0.31 110.81 177.033 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.417 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.24 -39.62 95.12 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.171 -1.048 . . . . 1.12 108.171 179.407 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.701 ' SG ' HD21 ' A' ' 17' ' ' LEU . 42.1 t -55.24 -53.04 61.12 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 113.989 -1.46 . . . . 0.26 110.735 174.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.798 HG22 ' HD2' ' A' ' 20' ' ' LYS . 65.9 t -63.14 -39.6 85.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.403 -0.362 . . . . 0.35 111.852 -177.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.463 ' HB3' HG21 ' A' ' 74' ' ' ILE . 2.5 mm-40 -65.57 -22.89 66.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.058 0.456 . . . . 2.51 110.917 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.412 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 49.1 m -79.28 -41.34 28.32 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.903 -0.777 . . . . 0.28 108.903 175.574 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.594 HG21 ' CD2' ' A' ' 17' ' ' LEU . 98.0 t -65.42 -32.94 60.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 114.999 -1.0 . . . . 1.23 109.293 179.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.36 -50.55 59.3 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 113.313 -1.767 . . . . 0.6 111.411 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.423 ' HB2' ' HG3' ' A' ' 119' ' ' MET . 10.9 mmtp -87.03 11.07 14.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.829 -0.623 . . . . 1.62 110.441 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 66.03 43.56 2.92 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-O 121.662 0.744 . . . . 1.88 110.227 -178.075 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.423 ' HG3' ' HB2' ' A' ' 117' ' ' LYS . 26.6 mtm -118.22 48.42 1.42 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.073 -1.084 . . . . 0.31 108.073 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.415 ' HG2' HG13 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -63.73 -7.27 7.18 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.641 -1.163 . . . . 1.15 112.529 -175.092 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.516 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 34.2 m -65.19 -27.2 41.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 120.708 0.29 . . . . 0.46 110.918 174.189 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.706 HD13 ' HD2' ' A' ' 125' ' ' ARG . 2.9 mm? -72.48 -27.33 62.22 Favored 'General case' 0 CA--C 1.51 -0.562 0 CA-C-N 116.589 -0.278 . . . . 0.26 110.684 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.68 HG22 ' SG ' ' A' ' 111' ' ' CYS . 70.3 t -44.22 -53.44 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 O-C-N 123.8 0.687 . . . . 0.25 111.938 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.2 -35.69 66.4 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.756 -0.656 . . . . 1.35 111.393 -178.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.706 ' HD2' HD13 ' A' ' 122' ' ' LEU . 70.8 mtt180 -64.78 -52.53 56.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.827 -0.624 . . . . 2.67 110.344 -178.399 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.592 HG22 ' SD ' ' A' ' 130' ' ' MET . 73.1 mt -54.11 -51.89 42.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.605 -0.725 . . . . 0.23 110.785 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.674 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -57.46 -36.34 71.3 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.713 0.292 . . . . 0.29 111.417 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.27 -58.8 6.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.288 0.566 . . . . 0.28 110.67 177.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -64.24 -33.71 76.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.021 -0.99 . . . . 3.91 111.49 -176.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.592 ' SD ' HG22 ' A' ' 126' ' ' ILE . 88.8 mtp -61.96 -54.59 39.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.04 0.448 . . . . 1.08 110.75 178.333 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.89 94.8 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.798 -0.637 . . . . 0.25 111.086 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 92.0 m -62.75 -43.9 97.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.875 0.369 . . . . 0.4 110.776 178.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.573 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 71.8 t80 -56.34 -42.85 78.39 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.226 -0.443 . . . . 3.13 110.032 176.285 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.933 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 4.9 tt -63.36 -48.01 79.72 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.102 -0.703 . . . . 0.95 109.102 175.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -49.83 -55.67 13.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.895 -0.593 . . . . 0.46 112.59 178.12 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -83.49 -47.2 11.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.064 0.459 . . . . 0.59 111.82 -173.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' HIS . . . . . 0.573 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 44.3 m-70 -90.92 -51.36 5.39 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 112.756 0.65 . . . . 1.45 112.756 -170.178 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.933 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -83.23 -46.59 12.49 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 114.515 1.302 . . . . 1.2 114.515 -165.072 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.603 ' HA ' HD12 ' A' ' 142' ' ' ILE . 28.3 tt0 -44.98 -52.42 19.4 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.432 0.53 . . . . 0.75 112.432 -173.301 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.619 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.3 Cg_exo -53.38 -53.52 6.49 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.654 1.57 . . . . 0.56 111.715 176.677 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -55.0 -51.11 67.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.583 -0.735 . . . . 1.2 110.347 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.603 HD12 ' HA ' ' A' ' 139' ' ' GLU . 73.6 mt -46.83 -53.89 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.823 -0.626 . . . . 0.32 111.805 174.416 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.601 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 77.3 mm-40 -61.95 -29.87 70.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.896 -0.593 . . . . 0.57 111.725 -178.656 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.619 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.6 mm-40 -64.81 -20.77 66.57 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.78 0.8 . . . . 0.78 109.898 175.532 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' ASN . . . . . 0.463 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 2.2 m-20 -104.23 2.26 31.46 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.89 -1.05 . . . . 0.93 108.783 -176.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 127.1 -54.39 0.77 Allowed Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 114.668 -1.151 . . . . 0.56 112.011 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' GLY . . . . . 0.453 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 137.41 -177.75 19.59 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.922 -0.656 . . . . 0.49 111.784 -177.439 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.442 ' HE1' HD13 ' A' ' 142' ' ' ILE . 11.8 m0 -68.02 -45.63 73.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.179 0.514 . . . . 3.57 110.084 -179.099 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -63.72 -34.57 78.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.458 -0.792 . . . . 1.96 111.123 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.579 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 66.0 m -66.77 -30.66 70.92 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.493 -0.322 . . . . 0.67 111.702 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.843 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 86.8 t80 -59.14 -38.54 79.95 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.339 -0.544 . . . . 3.0 109.84 174.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -75.83 -25.73 17.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.261 -0.427 . . . . 1.15 110.19 177.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.575 ' CG ' ' HA ' ' A' ' 150' ' ' THR . 55.1 mt-10 -55.52 -31.0 61.71 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-O 121.216 0.531 . . . . 1.67 109.835 172.108 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 150' ' ' THR . 0.6 OUTLIER -101.92 -50.67 3.61 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.397 -0.819 . . . . 1.3 110.984 -176.664 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 155' ' ' TYR . . . . . 0.46 ' CD2' ' HB2' ' A' ' 154' ' ' LEU . 97.9 m-85 -120.69 26.08 9.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.789 -0.641 . . . . 4.24 111.653 -170.073 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.588 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -60.22 164.12 15.21 Favored Glycine 0 C--N 1.317 -0.506 0 CA-C-O 121.733 0.629 . . . . 1.1 113.685 -176.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.569 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 12.2 t30 . . . . . 0 C--N 1.312 -1.048 0 CA-C-N 113.835 -1.182 . . . . 1.29 112.212 -176.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1005 ' ' GLY . . . . . 0.875 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.539 1.577 0 N-CA-C 111.902 -0.479 . . . . 1.2 111.902 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -133.14 -61.27 0.83 Allowed 'General case' 0 C--O 1.227 -0.111 0 C-N-CA 124.325 1.05 . . . . 2.88 110.387 -177.003 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -70.32 -49.44 49.4 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.14 -0.936 . . . . 1.31 112.593 -169.408 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.583 ' HB2' ' CD ' ' A' ' 89' ' ' GLU . 2.8 mm? -66.53 -39.82 88.8 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.084 -0.71 . . . . 1.33 109.084 -176.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B 1009 ' ' ALA . . . . . 1.028 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -52.19 -57.46 9.59 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.51 -1.223 . . . . 0.88 110.44 171.313 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -69.22 -38.05 78.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 113.905 -1.498 . . . . 1.03 112.276 -172.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 3.9 m-30 -74.77 -24.57 58.71 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.236 -0.438 . . . . 1.67 111.084 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1012 ' ' GLY . . . . . 0.5 ' HA2' ' HE1' ' A' ' 57' ' ' PHE . . . -76.95 -9.84 86.5 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 121.151 -0.547 . . . . 0.78 112.937 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.08 -23.66 66.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.962 0.411 . . . . 1.9 111.241 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 69.8 m . . . . . 0 C--N 1.328 -0.349 0 CA-C-O 120.838 0.351 . . . . 1.44 110.961 -175.146 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 . . . . . 0 N--CA 1.451 -0.388 0 CA-C-O 120.786 0.326 . . . . 2.42 111.77 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.518 ' HB3' ' OE2' ' A' ' 42' ' ' GLU . 4.8 m -67.6 -30.41 69.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.399 -0.364 . . . . 1.25 110.732 176.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.483 ' ND2' HD22 ' A' ' 134' ' ' LEU . 0.0 OUTLIER -62.3 -15.31 47.05 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.158 0.504 . . . . 1.78 110.109 -178.436 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.704 HH12 ' HA ' ' A' ' 128' ' ' ALA . 24.6 tpp180 -52.99 -49.94 65.16 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.368 -0.833 . . . . 1.4 110.743 174.801 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.611 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 42.8 mt-10 -52.6 -52.01 57.22 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.366 -1.288 . . . . 0.68 111.873 -174.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.58 HD21 HG11 ' A' ' 46' ' ' VAL . 0.4 OUTLIER -46.42 -45.96 18.34 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.163 -0.926 . . . . 1.16 110.788 177.656 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.665 HG13 ' HE2' ' A' ' 130' ' ' MET . 70.9 t -68.59 -61.36 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-O 121.253 0.549 . . . . 0.27 110.187 178.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 6' ' ' ARG . 63.3 t -51.65 -52.47 21.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 114.917 -1.038 . . . . 0.33 112.66 -173.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -58.98 -35.31 72.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.065 -0.516 . . . . 0.59 111.105 -176.128 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.699 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 26.9 t80 -77.35 -38.67 49.79 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 120.561 -0.456 . . . . 1.61 111.178 -176.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.811 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.3 mp -59.4 -38.78 81.46 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 119.825 -0.75 . . . . 0.34 109.499 175.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.453 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 40.6 t -60.8 -45.67 93.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.369 0.604 . . . . 1.05 110.581 175.238 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -62.08 -32.56 73.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.275 -0.875 . . . . 1.22 111.037 -178.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.609 ' HA ' ' CE ' ' A' ' 16' ' ' LYS . 4.4 mmpt? -72.46 -43.94 63.02 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 113.102 0.778 . . . . 1.41 113.102 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.658 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -64.39 -24.17 67.54 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.76 -0.376 . . . . 1.35 111.159 -178.376 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.0 t -58.09 -45.12 87.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.47 . . . . 0.94 111.554 -178.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -76.87 0.26 21.51 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.05 0.452 . . . . 1.37 111.834 -177.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.0 mmmt -109.98 -28.19 8.85 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.816 0.817 . . . . 2.2 109.313 -178.36 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.82 23.26 9.43 Favored Glycine 0 N--CA 1.442 -0.905 0 CA-C-N 114.087 -1.415 . . . . 0.53 111.303 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -116.16 166.78 11.64 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.234 -0.483 . . . . 0.76 110.395 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.427 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 5.6 t -110.27 147.61 33.52 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.11 -0.496 . . . . 0.52 110.048 179.618 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.453 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -77.35 -47.3 20.28 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.088 -0.505 . . . . 3.36 110.192 177.177 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.5 m -62.16 -36.13 80.92 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.773 0.286 . . . . 1.37 111.773 -178.04 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.427 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 96.6 mt-30 -55.0 -28.0 48.53 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.864 0.364 . . . . 1.11 111.908 -178.72 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.476 ' O ' ' HB2' ' A' ' 124' ' ' SER . 35.9 m-85 -116.6 -14.93 10.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.353 -0.385 . . . . 1.28 111.512 -175.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.58 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 50.8 m -101.37 153.56 19.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.727 0.775 . . . . 1.81 112.581 -176.179 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.436 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.2 t70 -125.8 -10.92 6.68 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.116 -1.402 . . . . 2.31 109.766 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.806 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.2 m -46.97 -71.26 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.926 -1.488 . . . . 0.92 113.1 -166.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.806 ' H ' HG23 ' A' ' 30' ' ' VAL . 8.1 pt-20 -99.32 1.82 44.85 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.203 -0.666 . . . . 2.74 109.203 177.303 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.436 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.7 tt0 . . . . . 0 N--CA 1.448 -0.542 0 CA-C-N 115.078 -0.964 . . . . 1.45 111.457 -175.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.635 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.3 OUTLIER . . . . . 0 CA--C 1.535 0.394 0 N-CA-C 110.035 -0.357 . . . . 1.12 110.035 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.64 ' CD ' ' H ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -91.62 -36.74 13.48 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 122.017 0.913 . . . . 2.02 109.515 171.209 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.793 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 75.0 m -69.07 -23.92 64.09 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 113.772 -1.558 . . . . 1.25 114.595 -165.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -56.95 -44.31 82.41 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 119.889 -0.724 . . . . 1.91 110.159 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.529 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -75.64 -39.71 57.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.017 0.436 . . . . 0.52 110.335 175.26 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.793 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 60.1 t -54.94 -60.38 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.508 -0.769 . . . . 1.41 111.671 178.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.611 ' NZ ' ' HB3' ' A' ' 7' ' ' GLU . 15.1 ptpt -60.07 -34.94 74.12 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.273 -0.64 . . . . 0.67 109.273 -178.28 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.427 ' OE1' ' HD2' ' A' ' 51' ' ' ARG . 22.8 mm-40 -66.6 -32.47 73.83 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.763 -0.653 . . . . 0.99 111.054 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.724 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -81.48 -35.67 30.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.351 0.596 . . . . 0.42 110.315 176.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.715 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.5 mp -66.56 -22.92 66.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.49 -0.777 . . . . 1.33 111.996 -177.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.539 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 8.3 ptp180 -86.18 -27.94 24.23 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.106 -0.702 . . . . 2.17 109.106 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.715 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.1 mm-40 -70.12 -47.93 59.66 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.653 -1.158 . . . . 1.1 109.524 174.418 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.416 ' HB2' ' HD2' ' A' ' 155' ' ' TYR . . . -68.02 -38.88 83.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.447 -0.797 . . . . 0.53 110.268 174.55 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.68 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -61.84 -42.78 99.78 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.51 -0.768 . . . . 0.7 112.489 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -54.08 -44.6 71.29 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.883 0.373 . . . . 1.04 111.04 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.415 ' HA ' ' CD2' ' A' ' 59' ' ' LEU . 37.3 mt-10 -63.38 -29.22 70.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.934 -0.575 . . . . 2.29 111.388 178.36 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.524 ' HZ ' HD12 ' B' 1008 ' ' LEU . 71.3 t80 -77.5 -39.87 44.82 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.207 -0.451 . . . . 2.29 110.294 177.588 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.68 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.4 mt-10 -62.81 -46.89 85.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.868 -0.605 . . . . 1.3 111.067 -176.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.514 HD12 ' N ' ' A' ' 60' ' ' ARG . 4.5 pp -59.25 -33.08 70.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.215 -0.448 . . . . 1.54 112.028 -175.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.514 ' N ' HD12 ' A' ' 59' ' ' LEU . 5.7 ptp85 -87.34 -35.38 18.42 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.332 -0.547 . . . . 2.58 112.353 -174.25 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.546 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 0.9 OUTLIER -91.63 -5.71 53.42 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 120.732 -0.387 . . . . 5.32 111.299 -178.436 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 58' ' ' GLU . 69.2 ttt180 -55.86 -32.5 63.7 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.285 -0.416 . . . . 4.48 111.644 -174.239 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -54.34 -39.35 67.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.837 -0.62 . . . . 4.72 111.96 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.409 ' HB1' HD13 ' A' ' 68' ' ' LEU . . . -90.72 -28.83 18.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.549 -0.296 . . . . 1.17 111.736 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.672 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 28.0 t80 -51.82 -38.55 56.24 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.86 0.689 . . . . 2.81 112.86 -172.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.1 p -72.03 -34.83 69.11 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.859 0.318 . . . . 2.19 111.859 -176.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -90.43 -32.21 16.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.914 0.388 . . . . 2.72 111.226 -175.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.44 ' HA ' ' HG3' ' A' ' 71' ' ' GLN . 3.6 mp -60.51 -17.35 44.98 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 112.864 0.69 . . . . 1.56 112.864 -175.693 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.528 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 3.0 p -58.9 -35.73 73.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 118.794 0.725 . . . . 0.7 110.403 -178.314 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.1 m -65.93 -28.59 69.04 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.192 -0.913 . . . . 1.34 110.437 175.201 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.44 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 34.0 mt-30 -86.9 -36.16 18.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.341 -0.845 . . . . 1.42 110.249 -177.436 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.565 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.4 mm? -65.39 -32.53 74.2 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 109.077 -0.712 . . . . 1.37 109.077 169.578 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.466 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 32.7 m80 66.11 39.01 4.49 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.292 -1.003 . . . . 2.72 108.292 -173.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.656 HG22 ' HE1' ' A' ' 119' ' ' MET . 29.0 mm -45.18 117.34 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 113.634 -1.621 . . . . 0.91 112.316 -177.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.762 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.7 -171.34 0.27 Allowed Pre-proline 0 N--CA 1.442 -0.872 0 CA-C-N 114.574 -1.194 . . . . 0.51 108.019 -171.078 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.762 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 52.7 Cg_exo -28.62 166.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.364 1.35 0 C-N-CA 125.299 3.999 . . . . 0.47 115.628 165.46 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.46 -30.34 0.01 OUTLIER Glycine 0 N--CA 1.47 0.962 0 N-CA-C 117.449 1.74 . . . . 0.4 117.449 -172.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.472 ' HA ' ' CD1' ' A' ' 80' ' ' TYR . 28.2 p -67.07 6.4 0.54 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.942 0.871 . . . . 0.56 112.576 -178.506 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.01 -10.4 57.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.327 0.584 . . . . 0.34 110.138 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.472 ' CD1' ' HA ' ' A' ' 78' ' ' THR . 4.9 p90 -73.97 -19.1 60.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.761 -0.654 . . . . 4.13 109.835 175.398 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.598 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 25.9 mt-30 -87.48 -18.27 30.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.763 0.792 . . . . 1.03 110.288 174.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.1 m -75.88 -53.42 8.46 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.663 -1.153 . . . . 0.48 108.844 170.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.442 ' CD2' ' HZ3' ' A' ' 129' ' ' TRP . 90.2 t80 -65.66 -15.39 62.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.85 -1.068 . . . . 1.18 110.06 174.017 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.632 ' HA ' HG12 ' A' ' 87' ' ' VAL . 28.7 tt0 -60.78 -49.08 78.91 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 121.773 0.797 . . . . 0.8 110.111 176.242 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.454 ' H ' ' HG2' ' A' ' 85' ' ' GLN . 62.8 mm-40 -50.16 -37.58 35.37 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.731 -1.577 . . . . 1.62 112.0 -176.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.571 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 3.6 p -91.62 -42.45 13.67 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 114.633 -1.167 . . . . 1.3 111.799 -176.594 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.632 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.9 p -59.71 -24.07 28.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 122.077 0.941 . . . . 0.85 109.399 176.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.3 m-80 -71.51 -39.78 70.58 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.037 -1.438 . . . . 0.91 111.691 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.762 ' HA ' ' HD2' ' A' ' 92' ' ' ARG . 1.6 pp20? -77.9 -32.44 51.76 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.53 0.681 . . . . 2.87 109.653 -179.071 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.619 HD12 HH11 ' A' ' 99' ' ' ARG . 0.2 OUTLIER -61.71 -30.97 71.11 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.214 -1.357 . . . . 1.28 112.008 -165.912 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.409 ' HA ' ' HB ' ' A' ' 95' ' ' VAL . 17.2 p90 -107.41 -30.06 8.89 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.208 0.447 . . . . 2.3 112.208 -175.139 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.762 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -65.27 -22.05 66.8 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.066 0.46 . . . . 5.06 111.901 -169.306 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.503 ' N ' ' HD3' ' A' ' 92' ' ' ARG . 28.1 t70 -92.91 -13.86 28.36 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.795 -0.638 . . . . 3.12 111.67 -172.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.16 69.78 0.11 Allowed Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 118.862 -1.637 . . . . 2.31 112.805 -173.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.562 HG13 ' CD1' ' A' ' 141' ' ' TRP . 0.1 OUTLIER -67.77 109.81 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 122.992 1.377 . . . . 1.06 110.499 -173.576 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.422 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 2.8 p30 -108.04 -170.89 1.76 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 113.391 -1.731 . . . . 2.12 109.653 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.97 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 15.8 m-90 -54.9 -42.64 72.41 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.571 -0.74 . . . . 3.34 110.664 177.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -77.27 -30.32 54.71 Favored Glycine 0 N--CA 1.452 -0.282 0 CA-C-N 115.909 -0.587 . . . . 0.69 113.567 -174.451 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.754 HH12 ' HA ' ' B' 1009 ' ' ALA . 16.5 mmt180 -59.97 -36.61 77.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.314 0.578 . . . . 4.24 111.368 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.472 HG12 ' HG ' ' A' ' 138' ' ' LEU . 94.5 mt -78.0 -32.35 17.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.601 -0.727 . . . . 0.44 111.895 -173.249 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 105' ' ' SER . 1.6 m -65.16 -22.97 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.401 0.619 . . . . 1.35 110.197 174.431 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.75 -42.85 19.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.205 0.526 . . . . 0.44 110.049 175.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.422 ' CE1' HG23 ' A' ' 87' ' ' VAL . 22.5 t80 -54.71 -55.11 33.34 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.891 -1.05 . . . . 1.49 111.358 177.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.715 ' CZ ' ' HB3' ' A' ' 50' ' ' LEU . 0.2 OUTLIER -70.87 -20.56 62.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.014 0.435 . . . . 3.29 110.292 -176.501 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.699 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 33.7 t -73.02 -50.61 22.1 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.927 -0.579 . . . . 1.19 110.362 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.461 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 18.2 t80 -70.28 -26.8 63.97 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 116.512 -0.313 . . . . 2.89 110.216 -178.184 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.722 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -70.44 -36.03 68.97 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.215 -0.993 . . . . 0.3 111.38 174.586 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.811 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -69.22 -33.88 74.32 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 110.855 -0.898 . . . . 0.23 110.855 173.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.672 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -69.81 -33.61 72.57 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.136 -0.532 . . . . 0.31 110.643 175.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.595 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -59.19 -39.78 83.67 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.253 1.025 . . . . 1.12 108.625 -179.723 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.641 ' SG ' HG22 ' A' ' 123' ' ' VAL . 35.6 t -53.0 -53.82 44.4 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 113.622 -1.626 . . . . 0.26 110.604 173.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.46 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 93.5 t -65.8 -38.44 82.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.261 -0.427 . . . . 0.35 111.07 -178.228 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.528 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 31.1 mt-10 -56.1 -34.06 65.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.015 0.436 . . . . 2.51 110.287 175.743 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.445 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 45.9 m -74.64 -39.13 62.28 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.412 0.625 . . . . 0.28 109.333 178.689 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 111' ' ' CYS . 91.0 t -66.37 -34.37 69.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.095 -0.957 . . . . 1.23 109.565 -179.305 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -52.12 -48.89 64.57 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.575 -1.648 . . . . 0.6 111.196 178.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.41 ' HB2' ' HG3' ' A' ' 119' ' ' MET . 28.7 mmtt -88.05 12.47 13.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.718 -0.674 . . . . 1.62 110.419 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 60.11 46.31 10.78 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.876 0.846 . . . . 1.88 110.714 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.656 ' HE1' HG22 ' A' ' 74' ' ' ILE . 27.3 mtm -118.69 45.86 1.96 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.462 -1.244 . . . . 0.31 107.738 178.376 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.407 ' HA ' HG23 ' A' ' 123' ' ' VAL . 1.0 OUTLIER -61.01 -7.28 2.36 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.373 -1.285 . . . . 1.15 113.156 -175.174 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.55 HG23 HD22 ' A' ' 122' ' ' LEU . 28.3 m -66.61 -25.8 35.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 O-C-N 122.025 -0.422 . . . . 0.46 111.197 173.382 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.772 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.4 mm? -71.91 -27.05 62.57 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 110.268 -0.271 . . . . 0.26 110.268 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.641 HG22 ' SG ' ' A' ' 111' ' ' CYS . 60.7 t -43.48 -53.6 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 123.777 0.673 . . . . 0.25 112.184 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.58 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 4.8 t -75.11 -34.62 61.73 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.749 -0.38 . . . . 1.35 110.542 -179.319 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.772 ' HD2' HD13 ' A' ' 122' ' ' LEU . 82.4 mtt180 -63.83 -51.6 63.93 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.243 -0.435 . . . . 2.67 110.787 -177.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.65 ' O ' ' HB2' ' A' ' 130' ' ' MET . 89.7 mt -54.52 -47.79 70.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.878 -0.601 . . . . 0.23 110.663 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.663 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.93 -25.53 57.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.239 -0.437 . . . . 0.29 111.962 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.704 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -68.75 -67.03 0.5 Allowed 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 121.117 0.484 . . . . 0.28 110.356 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.634 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 37.6 p-90 -75.69 -17.28 60.0 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.318 -0.855 . . . . 3.91 111.809 -176.132 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.722 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 0.3 OUTLIER -65.09 -44.68 88.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.428 . . . . 1.08 109.977 173.143 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.474 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -72.65 -38.87 67.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.385 -0.371 . . . . 0.25 110.125 176.739 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.597 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 38.0 m -59.76 -45.25 92.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.064 -0.517 . . . . 0.4 111.678 175.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.429 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 0.7 OUTLIER -56.11 -41.24 74.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.807 0.337 . . . . 3.13 110.578 177.693 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.788 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.4 tt -62.52 -50.54 70.98 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.864 -0.791 . . . . 0.95 108.864 173.44 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ASN . . . . . 0.427 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 5.2 m-80 -51.26 -48.57 62.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.879 -0.6 . . . . 0.46 112.398 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -80.99 -50.42 9.72 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.294 0.479 . . . . 0.59 112.294 -175.399 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' HIS . . . . . 0.429 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 1.7 m80 -90.64 -51.58 5.32 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.656 0.613 . . . . 1.45 112.656 -171.156 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.788 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -81.47 -46.98 13.76 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.612 0.968 . . . . 1.2 113.612 -168.644 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.768 ' HA ' HD12 ' A' ' 142' ' ' ILE . 34.1 tt0 -44.19 -52.92 14.94 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 113.259 0.837 . . . . 0.75 113.259 -172.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.6 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 38.8 Cg_exo -59.5 -44.23 33.97 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 121.647 1.565 . . . . 0.56 111.529 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' TRP . . . . . 0.562 ' CD1' HG13 ' A' ' 95' ' ' VAL . 1.5 t-105 -63.79 -42.93 97.63 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.48 -0.782 . . . . 1.2 110.203 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.768 HD12 ' HA ' ' A' ' 139' ' ' GLU . 49.5 mt -48.68 -50.25 13.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.053 0.454 . . . . 0.32 111.128 173.391 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.5 mm-40 -59.96 -31.79 70.21 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.521 -0.763 . . . . 0.57 111.46 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.2 mm-40 -65.14 -19.42 65.97 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.599 0.714 . . . . 0.78 110.733 176.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -111.16 5.14 19.85 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.198 -0.91 . . . . 0.93 110.408 -175.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 117.17 -42.26 1.9 Allowed Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.626 -0.715 . . . . 0.56 113.071 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' GLY . . . . . 0.583 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 132.8 -176.2 19.61 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.369 -0.92 . . . . 0.49 112.343 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.678 ' HZ2' ' HG3' ' A' ' 139' ' ' GLU . 12.9 m-90 -73.16 -47.24 45.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.046 0.451 . . . . 3.57 110.495 -177.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -59.85 -41.42 91.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.654 -0.703 . . . . 1.96 110.494 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.594 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 86.3 m -56.1 -35.22 66.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.924 -0.58 . . . . 0.67 111.404 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.97 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 64.4 t80 -61.1 -45.12 96.0 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.875 -0.33 . . . . 3.0 110.202 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.591 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -70.49 -24.6 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.474 0.654 . . . . 1.15 109.869 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -66.81 -22.99 66.0 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.276 -0.42 . . . . 1.67 110.403 173.296 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.1 mt -98.03 -55.84 2.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.296 0.57 . . . . 1.3 110.88 178.141 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 155' ' ' TYR . . . . . 0.416 ' HD2' ' HB2' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -121.7 27.41 8.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.439 -0.8 . . . . 4.24 110.416 -170.712 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.724 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -58.14 167.0 6.21 Favored Glycine 0 CA--C 1.503 -0.709 0 CA-C-O 121.834 0.686 . . . . 1.1 114.24 -178.042 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.715 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 8.7 t30 . . . . . 0 C--N 1.312 -1.057 0 CA-C-N 113.68 -1.26 . . . . 1.29 111.224 -177.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.405 0 N-CA-C 113.977 0.351 . . . . 1.2 113.977 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B 1006 ' ' ARG . . . . . 0.419 ' O ' ' HB3' ' B' 1009 ' ' ALA . 18.4 mmt180 -107.38 -37.04 6.34 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.672 0.619 . . . . 2.88 112.672 177.358 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -71.34 -61.6 1.71 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.884 0.698 . . . . 1.31 112.884 -165.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.673 HD22 ' H ' ' B' 1008 ' ' LEU . 1.9 mm? -61.86 -41.96 98.47 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.138 -0.689 . . . . 1.33 109.138 -177.518 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B 1009 ' ' ALA . . . . . 0.754 ' HA ' HH12 ' A' ' 99' ' ' ARG . . . -38.48 -56.87 1.22 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.333 -1.303 . . . . 0.88 111.645 169.589 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -73.51 -42.58 61.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.535 -1.211 . . . . 1.03 112.005 -174.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -70.86 -20.79 62.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.062 -0.517 . . . . 1.67 111.476 -177.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -75.52 -23.39 73.31 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.841 -0.695 . . . . 0.78 112.928 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.75 -19.51 62.53 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.988 0.423 . . . . 1.9 111.09 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 18.6 m . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 116.335 -0.393 . . . . 1.44 111.2 -173.978 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.7 tp60 . . . . . 0 CA--C 1.53 0.176 0 CA-C-O 121.333 0.587 . . . . 2.42 110.714 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.5 p -71.12 -12.33 61.44 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.975 -0.557 . . . . 1.25 111.388 -179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.893 ' HA ' HD22 ' A' ' 8' ' ' LEU . 3.4 p30 -66.29 -25.39 66.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.817 -0.628 . . . . 1.78 111.043 176.283 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.641 ' NH1' ' HB ' ' A' ' 30' ' ' VAL . 15.0 tpp85 -55.62 -50.37 70.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.933 -0.576 . . . . 1.4 110.618 175.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -59.41 -49.51 77.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.444 -0.798 . . . . 0.68 111.007 -176.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.893 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.1 OUTLIER -47.73 -39.45 17.75 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.102 -0.954 . . . . 1.16 111.287 176.874 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.3 t -73.13 -62.08 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.122 0.487 . . . . 0.27 110.253 176.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 6' ' ' ARG . 86.1 t -49.88 -49.15 21.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.17 -0.923 . . . . 0.33 113.092 -176.288 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -53.72 -37.21 63.09 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.797 0.332 . . . . 0.59 110.845 -176.027 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.608 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 21.5 t80 -78.47 -44.2 25.18 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.293 -0.412 . . . . 1.61 111.007 -178.199 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.809 HD22 ' HB2' ' A' ' 127' ' ' ALA . 6.1 mp -58.03 -42.7 85.88 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 120.435 -0.506 . . . . 0.34 109.905 177.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.1 t -58.95 -44.91 91.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.79 -0.641 . . . . 1.05 110.594 177.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.438 ' O ' ' HB3' ' A' ' 18' ' ' SER . 61.3 t80 -69.18 -29.61 67.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.971 -0.559 . . . . 1.22 110.844 -178.305 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.67 ' HE2' ' HA ' ' A' ' 16' ' ' LYS . 9.5 mmpt? -74.58 -32.24 62.32 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 120.666 0.27 . . . . 1.41 110.879 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.619 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -68.4 -28.17 66.86 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 120.283 -0.567 . . . . 1.35 109.626 174.737 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.438 ' HB3' ' O ' ' A' ' 15' ' ' TYR . 45.1 t -62.5 -36.17 81.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.651 -0.704 . . . . 0.94 112.06 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -79.07 -0.01 29.71 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.367 0.604 . . . . 1.37 111.243 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.609 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 19.9 mmmt -112.97 -28.66 7.63 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.783 0.801 . . . . 2.2 109.09 178.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.36 21.1 11.02 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.119 -1.401 . . . . 0.53 111.569 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.609 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 94.4 m-85 -110.2 167.24 10.34 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.571 -0.314 . . . . 0.76 110.24 178.683 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.586 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 6.6 t -111.47 149.97 30.56 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.034 0.445 . . . . 0.52 110.866 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.588 ' HZ2' ' HG2' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -65.47 -50.4 65.48 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.474 -0.785 . . . . 3.36 110.379 173.555 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.9 t -70.42 -24.63 62.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 1.37 111.588 -172.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.586 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 92.7 mt-30 -57.7 -32.29 67.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.006 0.432 . . . . 1.11 110.997 177.535 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.512 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 16.4 m-85 -114.76 -16.44 11.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.1 -0.5 . . . . 1.28 111.674 -173.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.608 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 24.8 m -100.97 152.04 21.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.721 0.772 . . . . 1.81 112.661 -175.1 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.476 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 2.7 t70 -127.81 -8.69 5.54 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.244 -1.344 . . . . 2.31 109.842 -177.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.819 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.3 m -51.39 -72.88 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.196 -1.365 . . . . 0.92 113.041 -169.187 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.819 ' H ' HG23 ' A' ' 30' ' ' VAL . 1.7 pm0 -100.57 3.04 42.38 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.089 0.471 . . . . 2.74 110.337 174.388 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.476 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 19.7 tt0 . . . . . 0 C--O 1.234 0.239 0 CA-C-N 115.618 -0.719 . . . . 1.45 111.324 178.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.958 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.8 t . . . . . 0 CA--C 1.538 0.514 0 N-CA-C 109.961 -0.385 . . . . 1.12 109.961 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.958 ' H ' HG23 ' A' ' 41' ' ' THR . 11.2 pt-20 -94.98 -29.05 14.83 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 122.96 1.362 . . . . 2.02 108.211 164.423 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.59 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.0 OUTLIER -62.91 -26.3 68.73 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 112.021 -2.354 . . . . 1.25 114.107 -166.951 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -55.56 -42.23 74.4 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.918 -0.313 . . . . 1.91 110.411 -179.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.542 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -79.48 -37.33 37.03 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.97 0.414 . . . . 0.52 110.354 176.274 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.673 ' HA ' ' CG1' ' A' ' 152' ' ' VAL . 99.7 t -58.11 -60.96 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.683 -0.69 . . . . 1.41 111.353 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.476 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 10.6 ptpt -59.41 -34.62 72.69 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.365 -0.605 . . . . 0.67 109.365 -178.097 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.51 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 22.2 mm-40 -66.59 -32.44 73.78 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.439 -0.801 . . . . 0.99 111.01 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.762 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -82.88 -35.02 26.55 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.303 0.573 . . . . 0.42 110.3 176.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.451 HD12 ' CE2' ' A' ' 151' ' ' PHE . 1.1 tp -63.06 -31.38 72.51 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.245 -0.889 . . . . 1.33 111.468 -177.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.476 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 9.5 ptp180 -79.05 -30.24 43.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.661 0.743 . . . . 2.17 109.098 -178.404 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.647 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.4 mm-40 -68.9 -47.93 64.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.58 -1.191 . . . . 1.1 109.799 177.436 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.2 -36.8 82.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.427 -0.806 . . . . 0.53 110.073 174.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.707 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.73 -44.05 98.4 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.46 -0.791 . . . . 0.7 112.144 179.097 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.447 ' O ' HD22 ' A' ' 59' ' ' LEU . 23.9 t70 -55.2 -39.65 69.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.785 0.326 . . . . 1.04 110.774 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.41 ' O ' HD21 ' A' ' 59' ' ' LEU . 57.3 mm-40 -65.38 -26.45 68.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.36 -0.836 . . . . 2.29 111.658 178.173 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -82.84 -33.51 27.09 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.516 -0.311 . . . . 2.29 111.205 175.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.772 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 38.2 mt-10 -69.4 -53.37 19.76 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 112.374 0.509 . . . . 1.3 112.374 -165.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.533 HD23 ' N ' ' A' ' 59' ' ' LEU . 2.3 pt? -52.31 -35.18 49.99 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 123.608 0.568 . . . . 1.54 110.477 -177.08 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 75.7 mtt180 -61.4 -58.86 6.48 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.424 -0.807 . . . . 2.58 112.055 -178.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.772 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 8.9 p90 -91.32 -6.57 52.9 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.028 0.381 . . . . 5.32 112.028 -173.255 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 58' ' ' GLU . 17.7 tpp85 -62.84 -30.77 71.75 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.95 0.352 . . . . 4.48 111.95 -171.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -65.16 -39.88 93.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.907 0.384 . . . . 4.72 110.196 178.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.432 ' HB1' ' CD1' ' A' ' 68' ' ' LEU . . . -77.21 -41.27 41.98 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.025 -0.534 . . . . 1.17 110.858 176.563 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.683 ' CZ ' ' HB1' ' A' ' 109' ' ' ALA . 39.4 t80 -43.42 -47.94 7.06 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.959 0.725 . . . . 2.81 112.959 -174.693 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.3 p -60.01 -37.17 78.95 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.785 0.326 . . . . 2.19 111.627 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -86.49 -29.62 22.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.311 0.576 . . . . 2.72 110.642 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.432 ' CD1' ' HB1' ' A' ' 64' ' ' ALA . 2.0 mp -59.73 -16.87 30.44 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.27 -0.877 . . . . 1.56 112.596 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.487 HG22 HG13 ' A' ' 74' ' ' ILE . 2.2 p -57.88 -27.81 63.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.839 0.291 . . . . 0.7 111.686 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -71.99 -33.75 68.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.652 0.739 . . . . 1.34 109.327 174.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -77.03 -38.39 52.97 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.123 -0.944 . . . . 1.42 110.036 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.708 HD21 ' HZ ' ' A' ' 106' ' ' PHE . 3.1 mm? -65.87 -32.87 74.63 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.559 -0.292 . . . . 1.37 110.514 172.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 59.7 m80 63.25 41.08 8.17 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.332 -0.988 . . . . 2.72 108.332 -172.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.644 HG22 ' HE1' ' A' ' 119' ' ' MET . 31.5 mm -46.71 115.22 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 113.975 -1.466 . . . . 0.91 112.057 -177.712 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.725 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.15 -174.83 0.45 Allowed Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 114.746 -1.115 . . . . 0.51 108.117 -168.234 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.725 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 23.4 Cg_exo -30.3 166.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 125.166 3.911 . . . . 0.47 115.001 165.203 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.595 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -28.82 -34.01 0.01 OUTLIER Glycine 0 N--CA 1.469 0.895 0 N-CA-C 116.931 1.532 . . . . 0.4 116.931 -170.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.448 ' N ' ' O ' ' A' ' 76' ' ' PRO . 22.2 p -62.32 3.87 0.17 Allowed 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.893 0.701 . . . . 0.56 112.893 -179.383 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.54 -13.16 62.19 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.207 0.527 . . . . 0.34 109.927 172.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.595 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 10.5 p90 -75.91 -18.29 59.44 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.526 -0.546 . . . . 4.13 109.526 174.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.462 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 93.8 mt-30 -77.57 -32.55 53.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.878 0.847 . . . . 1.03 109.135 172.652 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.9 m -68.37 -52.28 34.89 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.283 -1.326 . . . . 0.48 109.797 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -68.99 -17.97 63.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.046 -0.979 . . . . 1.18 110.349 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.57 ' HA ' HG12 ' A' ' 87' ' ' VAL . 44.3 tt0 -64.47 -48.78 73.97 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.02 -0.536 . . . . 0.8 110.502 177.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -46.48 -35.45 5.67 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.715 -1.13 . . . . 1.62 110.302 176.517 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.742 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.4 t -81.47 -54.82 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.018 0 CA-C-N 114.455 -1.248 . . . . 1.3 111.069 -176.268 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.57 HG12 ' HA ' ' A' ' 84' ' ' GLU . 10.6 p -58.11 -26.39 29.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.591 0.71 . . . . 0.85 109.567 -178.729 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.489 ' O ' ' HB3' ' A' ' 92' ' ' ARG . 2.3 m-80 -68.07 -40.87 82.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.521 -1.218 . . . . 0.91 111.833 175.6 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.951 ' HG2' ' HA2' ' B' 1005 ' ' GLY . 0.3 OUTLIER -79.41 -33.54 42.59 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-O 121.691 0.758 . . . . 2.87 109.756 179.259 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.697 ' HA ' ' NH1' ' A' ' 99' ' ' ARG . 42.3 mt -68.31 -22.22 64.72 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 114.392 -1.277 . . . . 1.28 112.146 -168.304 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.556 ' HD1' ' O ' ' A' ' 87' ' ' VAL . 6.2 p90 -108.75 -24.76 11.16 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.719 -0.392 . . . . 2.3 111.93 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.639 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -68.45 -25.69 65.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.823 0.344 . . . . 5.06 111.685 -171.719 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.435 ' HB2' ' NE ' ' A' ' 92' ' ' ARG . 26.8 t70 -97.61 -1.27 44.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.198 -0.456 . . . . 3.12 111.945 -170.302 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.03 67.86 0.11 Allowed Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 118.847 -1.644 . . . . 2.31 113.335 -176.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.594 HG13 ' CD1' ' A' ' 141' ' ' TRP . 0.2 OUTLIER -70.54 100.61 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 123.045 1.402 . . . . 1.06 110.85 -177.485 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.539 ' HA ' HD22 ' A' ' 145' ' ' ASN . 1.2 p30 -110.19 -171.53 1.85 Allowed 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 113.124 -1.853 . . . . 2.12 108.782 172.108 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.691 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 16.0 m-90 -46.09 -52.37 12.17 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.732 0.645 . . . . 3.34 110.964 178.486 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.43 -28.14 73.26 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.362 -0.835 . . . . 0.69 114.414 -175.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.747 HH12 ' HA ' ' B' 1009 ' ' ALA . 12.7 mmt180 -72.22 -38.0 69.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.156 0.478 . . . . 4.24 111.176 -175.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.555 HG12 ' HG ' ' A' ' 138' ' ' LEU . 94.1 mt -70.29 -33.06 52.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.725 -0.67 . . . . 0.44 110.404 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 97' ' ' TRP . 47.0 t -56.31 -54.59 26.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.356 -0.838 . . . . 1.35 109.935 170.67 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -51.1 -47.58 61.9 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.774 -0.648 . . . . 0.44 111.013 176.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.539 ' HA ' HD13 ' A' ' 90' ' ' LEU . 11.3 t80 -55.3 -53.1 60.43 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.939 -1.028 . . . . 1.49 111.993 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.569 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.2 OUTLIER -76.6 -21.85 55.02 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.794 -0.362 . . . . 3.29 110.685 -175.033 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.608 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 47.1 t -70.08 -54.66 12.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 1.19 110.615 177.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.708 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 41.9 t80 -64.31 -26.6 68.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.039 0.447 . . . . 2.89 109.873 178.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.499 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -69.72 -46.96 51.44 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.809 -0.632 . . . . 0.3 112.653 178.016 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.804 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -60.42 -33.46 81.23 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.36 -0.924 . . . . 0.23 110.942 175.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.683 ' HB1' ' CZ ' ' A' ' 65' ' ' PHE . . . -72.11 -30.46 65.09 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.023 -0.589 . . . . 0.31 111.01 176.691 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.7 -42.42 99.63 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.731 -0.84 . . . . 1.12 108.731 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.645 ' SG ' HG13 ' A' ' 123' ' ' VAL . 32.9 t -50.32 -53.22 30.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.915 -1.493 . . . . 0.26 110.933 174.054 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.47 HG11 ' HD3' ' A' ' 20' ' ' LYS . 53.1 t -62.52 -44.64 99.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.884 -0.598 . . . . 0.35 111.962 -176.416 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.537 ' HB3' HG21 ' A' ' 74' ' ' ILE . 21.2 mm-40 -60.79 -26.04 66.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.929 0.395 . . . . 2.51 111.381 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.501 ' HB3' ' HB2' ' A' ' 122' ' ' LEU . 23.7 m -73.35 -38.51 65.72 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.617 -0.883 . . . . 0.28 108.617 174.513 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 111' ' ' CYS . 88.2 t -68.73 -37.36 77.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.257 -0.883 . . . . 1.23 109.479 -178.229 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -55.78 -51.02 68.84 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 113.531 -1.668 . . . . 0.6 111.516 -177.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' A' ' 113' ' ' GLU . 15.0 mmtt -85.79 15.89 4.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.937 -0.574 . . . . 1.62 110.071 -178.274 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 65.19 48.32 2.22 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.524 -0.762 . . . . 1.88 110.832 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.644 ' HE1' HG22 ' A' ' 74' ' ' ILE . 25.5 mtm -128.15 43.36 3.15 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.044 -1.095 . . . . 0.31 108.044 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.613 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 0.0 OUTLIER -61.47 -7.69 3.4 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.976 -1.011 . . . . 1.15 113.131 -175.458 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.55 HG23 HD22 ' A' ' 122' ' ' LEU . 25.6 m -66.5 -24.78 33.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 122.042 -0.411 . . . . 0.46 111.079 174.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.643 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -71.7 -27.02 62.74 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 116.537 -0.301 . . . . 0.26 110.19 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.645 HG13 ' SG ' ' A' ' 111' ' ' CYS . 65.5 t -45.97 -54.03 2.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 123.735 0.647 . . . . 0.25 112.116 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.608 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 3.4 t -74.95 -26.02 59.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.901 0.381 . . . . 1.35 110.491 -177.511 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.643 ' HD2' HD13 ' A' ' 122' ' ' LEU . 91.4 mtt180 -71.5 -53.15 14.85 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.337 -0.392 . . . . 2.67 110.002 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.528 HD12 ' HA ' ' A' ' 111' ' ' CYS . 76.2 mt -54.46 -50.39 58.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.594 -0.73 . . . . 0.23 111.532 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.809 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -57.13 -37.07 71.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.871 0.367 . . . . 0.29 110.967 179.458 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -61.52 -56.96 14.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.701 0.762 . . . . 0.28 110.241 175.16 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.534 ' CZ2' ' HB3' ' A' ' 125' ' ' ARG . 36.4 m0 -56.79 -46.51 81.49 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.148 -1.387 . . . . 3.91 110.754 -178.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.574 ' SD ' HD11 ' A' ' 13' ' ' LEU . 88.6 mtp -59.36 -54.07 51.0 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.985 -0.552 . . . . 1.08 111.459 -177.732 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.78 -34.24 75.52 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.044 -0.526 . . . . 0.25 110.318 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 54.9 m -65.81 -48.82 70.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.186 -0.461 . . . . 0.4 111.004 175.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.493 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 6.5 m-85 -54.56 -42.58 71.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.438 -0.346 . . . . 3.13 110.471 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.801 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.7 tt -61.59 -50.53 72.21 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 109.029 -0.73 . . . . 0.95 109.029 173.573 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -50.51 -56.44 11.61 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.247 0.462 . . . . 0.46 112.247 179.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.49 -48.23 15.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.069 0.461 . . . . 0.59 111.866 -171.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' HIS . . . . . 0.493 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 52.4 m-70 -90.49 -51.49 5.38 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 112.7 0.63 . . . . 1.45 112.7 -170.711 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.801 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -86.07 -42.59 13.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 114.552 1.315 . . . . 1.2 114.552 -165.716 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.654 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 27.5 tt0 -43.85 -51.8 16.38 Favored Pre-proline 0 N--CA 1.47 0.539 0 N-CA-C 112.797 0.666 . . . . 0.75 112.797 -173.507 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.582 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 47.6 Cg_exo -55.08 -46.06 36.01 Favored 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 121.901 1.734 . . . . 0.56 111.824 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 141' ' ' TRP . . . . . 0.594 ' CD1' HG13 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -61.39 -41.02 96.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.581 -0.736 . . . . 1.2 110.802 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.475 HD12 ' HA ' ' A' ' 139' ' ' GLU . 3.5 mt -54.55 -47.64 71.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.103 0.478 . . . . 0.32 110.628 174.624 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.654 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 67.0 mm-40 -58.24 -34.19 70.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.415 -0.811 . . . . 0.57 110.916 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.4 mm-40 -65.19 -23.17 67.02 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 121.46 0.647 . . . . 0.78 110.892 178.48 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' ASN . . . . . 0.539 HD22 ' HA ' ' A' ' 96' ' ' ASN . 2.3 m-20 -102.12 2.74 37.8 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.164 -0.926 . . . . 0.93 109.315 -174.656 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.6 -44.14 1.53 Allowed Glycine 0 N--CA 1.439 -1.1 0 CA-C-N 114.813 -1.085 . . . . 0.56 112.436 177.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 138.66 175.78 14.18 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.728 -0.749 . . . . 0.49 111.911 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.408 ' HB3' HG11 ' A' ' 46' ' ' VAL . 5.5 m-90 -68.27 -43.93 76.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.776 0.322 . . . . 3.57 110.697 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.419 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 23.4 t70 -63.11 -39.65 95.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.115 -0.493 . . . . 1.96 109.908 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.548 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 94.1 m -56.25 -36.67 68.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.605 -0.725 . . . . 0.67 111.069 177.31 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.691 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 75.1 t80 -59.98 -42.97 95.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.837 0.351 . . . . 3.0 110.277 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.673 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.1 m -73.4 -24.75 20.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.408 0.623 . . . . 1.15 110.05 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 8.2 mm-40 -64.49 -23.63 67.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.016 0.436 . . . . 1.67 109.908 173.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 150' ' ' THR . 1.9 mt -98.52 -53.46 3.32 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.964 -0.562 . . . . 1.3 110.768 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -120.79 26.44 9.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.684 -0.689 . . . . 4.24 111.436 -170.32 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.762 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -57.83 160.2 11.92 Favored Glycine 0 N--CA 1.448 -0.527 0 CA-C-N 116.102 -0.499 . . . . 1.1 113.638 -177.53 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.647 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 10.2 t30 . . . . . 0 C--N 1.314 -0.972 0 CA-C-N 113.691 -1.254 . . . . 1.29 112.317 -177.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1005 ' ' GLY . . . . . 0.951 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.534 1.252 0 N-CA-C 114.512 0.565 . . . . 1.2 114.512 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -98.87 -27.21 14.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 117.537 0.668 . . . . 2.88 112.171 173.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1007 ' ' ALA . . . . . 0.43 ' O ' ' HD2' ' B' 1011 ' ' PHE . . . -91.96 -65.44 1.01 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.235 0.457 . . . . 1.31 112.235 -169.285 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.603 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 18.2 mt -66.5 -35.91 81.44 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.946 -0.761 . . . . 1.33 108.946 -176.396 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B 1009 ' ' ALA . . . . . 0.747 ' HA ' HH12 ' A' ' 99' ' ' ARG . . . -42.25 -58.62 2.1 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.681 -1.145 . . . . 0.88 111.351 165.071 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -72.07 -40.21 68.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.136 -0.938 . . . . 1.03 111.789 -175.225 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1011 ' ' PHE . . . . . 0.43 ' HD2' ' O ' ' B' 1007 ' ' ALA . 36.9 m-85 -67.65 -24.49 65.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.111 0.481 . . . . 1.67 110.397 177.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -79.64 -5.1 89.46 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.681 -0.69 . . . . 0.78 112.456 178.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 20.8 t70 -74.85 -22.0 58.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.428 0.632 . . . . 1.9 109.685 175.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 28.3 m . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 115.571 -0.74 . . . . 1.44 112.33 -173.215 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 37.8 tp60 . . . . . 0 CA--C 1.535 0.393 0 CA-C-O 120.83 0.348 . . . . 2.42 111.619 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.417 ' OG ' ' HB3' ' A' ' 43' ' ' SER . 11.7 t -70.63 -15.2 62.71 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.068 0.461 . . . . 1.25 110.563 176.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.818 ' HA ' HD22 ' A' ' 8' ' ' LEU . 7.2 p30 -56.88 -20.83 25.3 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.269 -0.423 . . . . 1.78 111.226 176.357 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.515 ' O ' HG23 ' A' ' 10' ' ' VAL . 6.8 tpp180 -59.49 -56.2 25.03 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.971 -0.559 . . . . 1.4 110.393 174.513 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.425 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 42.5 mt-10 -57.01 -48.1 79.29 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 115.117 -0.947 . . . . 0.68 110.968 -178.363 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.818 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.1 OUTLIER -49.17 -31.64 8.76 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.933 -1.031 . . . . 1.16 111.592 178.75 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.535 HG21 ' N ' ' A' ' 131' ' ' ALA . 78.3 t -81.04 -63.01 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-O 121.555 0.693 . . . . 0.27 109.897 172.242 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 6' ' ' ARG . 55.2 t -54.18 -46.93 67.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.565 -1.198 . . . . 0.33 113.066 -171.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -56.17 -38.99 71.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.66 0.267 . . . . 0.59 110.979 -177.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.714 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 14.7 t80 -71.96 -42.19 66.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.302 -0.408 . . . . 1.61 110.217 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 1.025 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.5 mp -60.53 -41.18 93.92 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 120.499 -0.48 . . . . 0.34 109.952 176.59 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.496 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 23.0 t -61.2 -47.39 86.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 1.05 110.489 178.467 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -62.4 -30.95 71.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.78 -0.646 . . . . 1.22 110.738 177.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.711 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.4 OUTLIER -81.24 -33.83 32.55 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-N 116.109 -0.496 . . . . 1.41 112.276 -173.815 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.586 ' O ' ' HD3' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -62.23 -27.73 69.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.371 0.605 . . . . 1.35 110.024 174.509 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.4 t -71.39 -16.25 62.4 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.627 -0.715 . . . . 0.94 111.56 -176.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.711 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 19.7 pt20 -79.19 -12.76 59.97 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.356 0.598 . . . . 1.37 111.506 -176.059 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.777 ' NZ ' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -115.51 -20.05 10.37 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 122.197 0.999 . . . . 2.2 109.412 179.415 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.28 28.97 5.59 Favored Glycine 0 C--N 1.306 -1.101 0 CA-C-N 113.696 -1.593 . . . . 0.53 112.931 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -112.77 168.41 9.7 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.724 0.297 . . . . 0.76 111.06 169.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.491 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 5.6 t -110.57 152.31 26.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.341 -0.391 . . . . 0.52 110.743 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.496 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.5 OUTLIER -75.19 -46.7 32.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.972 -0.558 . . . . 3.36 110.279 173.094 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.428 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 13.2 p -65.85 -25.34 67.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.358 -0.383 . . . . 1.37 111.5 -173.366 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.491 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 97.3 mt-30 -63.43 -30.29 71.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.931 0.396 . . . . 1.11 111.051 176.451 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -121.85 18.51 11.01 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.052 -0.522 . . . . 1.28 111.777 -173.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.428 ' OG ' ' HA ' ' A' ' 25' ' ' SER . 93.3 p -101.02 -178.68 3.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.912 0.863 . . . . 1.81 113.156 -171.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.496 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.3 t70 -165.34 -25.52 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.586 -1.643 . . . . 2.31 108.43 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.899 HG23 ' H ' ' A' ' 31' ' ' GLU . 15.2 m -55.29 -72.12 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 114.1 -1.409 . . . . 0.92 113.014 -174.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.899 ' H ' HG23 ' A' ' 30' ' ' VAL . 34.8 mt-10 -90.17 0.03 57.38 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.759 0.79 . . . . 2.74 108.873 177.313 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 30.8 tt0 . . . . . 0 N--CA 1.443 -0.785 0 CA-C-N 114.53 -1.214 . . . . 1.45 110.453 -178.181 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.737 HG23 ' OE2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.514 0 N-CA-C 110.147 -0.316 . . . . 1.12 110.147 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.737 ' OE2' HG23 ' A' ' 41' ' ' THR . 0.0 OUTLIER -94.18 -32.85 13.54 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.806 0.812 . . . . 2.02 109.814 170.222 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.801 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 5.4 p -56.63 -36.29 69.3 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 113.94 -1.482 . . . . 1.25 113.613 -171.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -46.14 -43.65 15.14 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 123.311 0.382 . . . . 1.91 111.894 -173.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.431 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -83.42 -36.86 23.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.777 0.322 . . . . 0.52 110.482 176.124 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.682 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 79.0 t -54.91 -66.58 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 CA-C-N 115.753 -0.658 . . . . 1.41 111.174 177.042 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.801 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.8 ptpt -58.26 -37.99 76.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.783 -0.644 . . . . 0.67 110.353 -177.416 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.488 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 41.6 mm-40 -63.84 -26.38 68.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.645 -0.707 . . . . 0.99 111.402 175.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.57 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -84.97 -32.03 23.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.437 0.637 . . . . 0.42 109.819 177.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 9.8 mt -67.91 -21.46 65.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.054 -0.976 . . . . 1.33 111.216 -175.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.442 ' HD2' ' OE1' ' A' ' 48' ' ' GLN . 13.0 ptp180 -89.73 -35.31 15.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.574 0.702 . . . . 2.17 109.485 -178.447 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.743 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.0 mm-40 -67.65 -46.13 73.32 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.789 -1.096 . . . . 1.1 109.396 175.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -71.44 -33.19 69.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.416 -0.811 . . . . 0.53 110.325 176.077 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.644 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -63.26 -43.63 98.21 Favored Glycine 0 CA--C 1.507 -0.463 0 CA-C-N 115.896 -0.593 . . . . 0.7 111.759 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.58 ' O ' HD22 ' A' ' 59' ' ' LEU . 28.5 t70 -56.54 -34.74 67.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.873 0.368 . . . . 1.04 110.735 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -68.28 -26.85 65.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.288 -0.869 . . . . 2.29 111.72 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -83.25 -39.19 21.2 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.117 -0.492 . . . . 2.29 111.352 176.252 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.763 ' HA ' ' CE2' ' A' ' 61' ' ' TYR . 43.6 mt-10 -66.97 -53.39 32.08 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 112.892 0.701 . . . . 1.3 112.892 -166.339 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.58 HD22 ' O ' ' A' ' 55' ' ' ASP . 2.3 pt? -51.31 -35.04 35.99 Favored 'General case' 0 C--N 1.32 -0.676 0 O-C-N 123.787 0.68 . . . . 1.54 111.021 -172.404 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 79.8 mtt-85 -64.82 -52.35 57.23 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.213 -0.903 . . . . 2.58 111.621 -178.011 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.763 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 16.4 p90 -91.62 -14.43 30.2 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.082 0.401 . . . . 5.32 112.082 -174.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -60.06 -17.29 38.32 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.029 0.381 . . . . 4.48 112.029 -170.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -61.54 -36.64 81.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.016 0.436 . . . . 4.72 110.72 177.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.619 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -91.43 -24.1 19.82 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.018 0.377 . . . . 1.17 112.018 -179.162 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.535 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 55.0 t80 -40.99 -52.97 3.07 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.621 0.971 . . . . 2.81 113.621 -171.372 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.0 t -69.09 -23.4 64.0 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.904 0.383 . . . . 2.19 111.25 -172.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -89.97 -28.56 19.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.307 -0.406 . . . . 2.72 111.14 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 48.6 mt -70.69 -18.49 62.82 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 112.455 0.539 . . . . 1.56 112.455 -173.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.499 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 2.1 p -55.21 -37.21 66.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.095 0.474 . . . . 0.7 111.189 -178.588 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 28.2 t -61.42 -35.47 77.64 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.599 -0.728 . . . . 1.34 109.983 175.429 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -80.6 -35.44 34.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.336 -0.847 . . . . 1.42 110.616 -177.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.521 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.4 mm? -65.61 -33.12 75.17 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.784 -0.45 . . . . 1.37 109.784 172.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.477 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 72.8 m80 67.81 42.63 1.91 Allowed 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 108.254 -1.017 . . . . 2.72 108.254 -172.548 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.521 HG12 ' HB2' ' A' ' 72' ' ' LEU . 28.4 mm -53.32 114.95 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 114.039 -1.437 . . . . 0.91 111.114 179.135 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.783 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.76 -168.72 0.21 Allowed Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 107.369 -1.345 . . . . 0.51 107.369 -171.504 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.783 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 71.6 Cg_exo -28.96 165.79 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.507 3.471 . . . . 0.47 115.183 163.057 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.61 -26.54 0.0 OUTLIER Glycine 0 N--CA 1.475 1.291 0 N-CA-C 118.258 2.063 . . . . 0.4 118.258 -171.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.47 ' N ' ' O ' ' A' ' 76' ' ' PRO . 45.4 p -69.29 6.49 0.99 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.493 1.146 . . . . 0.56 112.125 -179.384 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.406 ' HA ' ' OG ' ' A' ' 82' ' ' SER . . . -71.93 -12.48 61.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.286 0.565 . . . . 0.34 110.237 173.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -77.52 -19.75 55.3 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.261 -0.644 . . . . 4.13 109.261 175.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.467 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 30.3 mt-30 -84.39 -20.8 31.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.867 0.841 . . . . 1.03 109.687 173.697 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.406 ' OG ' ' HA ' ' A' ' 79' ' ' ALA . 3.0 m -74.42 -51.6 14.49 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 114.502 -1.226 . . . . 0.48 109.094 170.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.424 ' HA ' HG23 ' A' ' 86' ' ' VAL . 66.6 t80 -66.27 -17.91 65.03 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.991 -1.004 . . . . 1.18 110.149 175.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.525 ' HA ' HG12 ' A' ' 87' ' ' VAL . 32.1 tt0 -59.47 -51.31 70.4 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-O 121.624 0.726 . . . . 0.8 109.869 178.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.481 ' H ' ' HG2' ' A' ' 85' ' ' GLN . 55.4 mm-40 -48.22 -32.64 7.42 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 113.456 -1.702 . . . . 1.62 110.706 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.607 ' HA ' ' HG3' ' A' ' 89' ' ' GLU . 0.8 OUTLIER -89.06 -51.36 12.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 113.961 -1.472 . . . . 1.3 111.25 -175.413 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.525 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.9 p -60.96 -22.17 26.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-O 121.824 0.821 . . . . 0.85 109.372 -177.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.456 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 5.1 m-80 -77.45 -36.91 52.52 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 113.982 -1.463 . . . . 0.91 111.858 175.382 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.973 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.0 OUTLIER -83.91 -17.34 41.08 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 121.951 0.882 . . . . 2.87 110.284 179.88 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.686 ' HG ' HH11 ' A' ' 99' ' ' ARG . 0.0 OUTLIER -75.43 -50.74 14.9 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 114.98 -1.009 . . . . 1.28 110.525 -179.483 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.456 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 4.4 p90 -88.36 -23.71 23.31 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.204 0.816 . . . . 2.3 113.204 -166.632 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.685 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -58.19 -39.55 79.24 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.454 0.909 . . . . 5.06 113.454 -165.23 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -110.08 22.94 14.97 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 115.113 1.523 . . . . 3.12 115.113 -167.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 134.41 73.63 0.08 OUTLIER Glycine 0 C--N 1.318 -0.462 0 C-N-CA 117.457 -2.306 . . . . 2.31 115.303 -176.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.641 HG22 HH21 ' A' ' 99' ' ' ARG . 89.0 t -71.72 102.69 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.79 0.805 . . . . 1.06 111.56 178.21 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -112.01 -174.87 2.55 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.784 -1.098 . . . . 2.12 109.531 -179.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.605 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 18.7 m-90 -59.8 -60.64 3.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.111 0.481 . . . . 3.34 110.643 178.461 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.553 ' O ' ' HB ' ' A' ' 101' ' ' VAL . . . -66.66 -25.84 72.9 Favored Glycine 0 C--N 1.33 0.211 0 CA-C-N 115.647 -0.706 . . . . 0.69 112.544 -176.698 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.686 HH11 ' HG ' ' A' ' 90' ' ' LEU . 1.1 tmm_? -64.67 -39.87 94.43 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.475 -0.565 . . . . 4.24 109.475 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.606 HG22 ' CE2' ' A' ' 104' ' ' PHE . 82.9 mt -69.86 -33.14 54.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.266 -0.425 . . . . 0.44 110.406 178.395 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.553 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 91.6 t -51.46 -57.14 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-N 116.002 -0.545 . . . . 1.35 110.44 170.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -47.76 -41.84 24.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.012 -0.994 . . . . 0.44 111.52 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.468 ' HB3' ' O ' ' A' ' 100' ' ' ILE . 27.5 t80 -60.29 -43.1 96.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.999 -1.001 . . . . 1.49 110.934 178.214 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.606 ' CE2' HG22 ' A' ' 100' ' ' ILE . 37.4 m-85 -68.41 -37.64 80.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.325 . . . . 3.29 110.565 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.714 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 16.2 m -61.82 -54.88 36.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.861 -0.609 . . . . 1.19 111.071 -176.616 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -72.56 -31.04 64.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.823 0.344 . . . . 2.89 110.281 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.655 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -66.79 -43.73 90.98 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.87 -0.681 . . . . 0.3 111.81 177.361 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 1.025 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.85 -29.02 73.39 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.686 -0.769 . . . . 0.23 111.189 175.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.535 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -72.7 -34.14 66.93 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.402 -0.399 . . . . 0.31 110.244 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.523 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.3 OUTLIER -65.57 -34.64 78.72 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.933 0.873 . . . . 1.12 109.996 -179.072 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.68 ' O ' HG23 ' A' ' 115' ' ' VAL . 43.0 t -51.89 -50.04 61.83 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.268 -1.333 . . . . 0.26 109.369 171.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.777 HG13 ' NZ ' ' A' ' 20' ' ' LYS . 97.1 t -64.9 -36.24 77.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 116.268 -0.424 . . . . 0.35 110.527 176.335 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.523 ' OE2' ' HA ' ' A' ' 110' ' ' LEU . 37.5 mt-10 -54.65 -37.63 65.93 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.073 0.463 . . . . 2.51 110.341 175.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 21.1 m -78.85 -38.79 37.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.983 -0.553 . . . . 0.28 109.995 -178.642 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.68 HG23 ' O ' ' A' ' 111' ' ' CYS . 93.6 t -68.53 -33.26 59.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.716 0.77 . . . . 1.23 109.197 -177.509 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -55.67 -50.13 71.08 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 113.757 -1.565 . . . . 0.6 111.575 -178.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -87.5 13.48 10.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.932 -0.576 . . . . 1.62 110.211 -178.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 63.88 52.02 2.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.821 0.819 . . . . 1.88 111.502 -178.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.59 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 25.9 mtm -130.64 48.37 2.42 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.751 -1.203 . . . . 0.31 107.751 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.498 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 0.0 OUTLIER -64.17 -8.26 11.75 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 114.756 -1.111 . . . . 1.15 112.4 -173.608 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.581 HG23 HD22 ' A' ' 122' ' ' LEU . 28.2 m -64.62 -19.66 25.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.808 0.337 . . . . 0.46 111.575 176.16 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.617 HD13 ' HD3' ' A' ' 125' ' ' ARG . 3.1 mm? -79.81 -24.29 41.5 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.468 -0.333 . . . . 0.26 110.146 178.588 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.662 HG13 ' SG ' ' A' ' 111' ' ' CYS . 56.7 t -46.93 -56.72 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 O-C-N 123.658 0.599 . . . . 0.25 111.849 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.415 ' OG ' HG13 ' A' ' 30' ' ' VAL . 6.6 t -71.1 -29.84 65.79 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.712 -0.395 . . . . 1.35 110.275 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.617 ' HD3' HD13 ' A' ' 122' ' ' LEU . 17.2 mtp180 -65.1 -58.51 5.85 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 116.283 -0.417 . . . . 2.67 110.857 178.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 122' ' ' LEU . 79.2 mt -49.93 -49.9 20.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.58 -0.737 . . . . 0.23 110.565 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.666 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -59.04 -36.49 75.11 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.727 0.299 . . . . 0.29 111.528 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.26 -56.69 11.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.504 0.668 . . . . 0.28 110.936 177.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.486 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 94.3 m95 -64.47 -35.0 79.53 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.809 -1.087 . . . . 3.91 111.182 -176.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.655 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 1.2 mmm -63.87 -50.5 68.58 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.073 0.463 . . . . 1.08 110.824 177.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.535 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -63.48 -34.81 78.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.859 -0.61 . . . . 0.25 110.472 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 69.4 m -64.46 -48.12 76.46 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.165 -0.47 . . . . 0.4 110.955 177.238 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -56.95 -39.56 74.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.814 0.34 . . . . 3.13 110.094 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.624 HD13 ' HB2' ' A' ' 5' ' ' ASN . 5.6 tt -60.93 -52.08 66.55 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.702 -0.851 . . . . 0.95 108.702 173.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -50.58 -49.09 57.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.742 -0.663 . . . . 0.46 112.023 179.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.96 -53.43 6.75 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.028 0.442 . . . . 0.59 111.485 -174.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.7 -51.07 5.42 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 112.953 0.723 . . . . 1.45 112.953 -169.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 40.6 mt -86.68 -31.57 20.97 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.908 0.707 . . . . 1.2 112.908 -163.307 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 31.1 tt0 -51.76 -51.95 65.48 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 112.247 0.462 . . . . 0.75 112.247 -173.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.583 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 32.9 Cg_exo -59.48 -46.68 19.79 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 121.621 1.547 . . . . 0.56 111.643 176.343 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' TRP . . . . . 0.52 ' CE2' ' HB ' ' A' ' 95' ' ' VAL . 0.5 OUTLIER -53.32 -53.32 52.7 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.658 -0.701 . . . . 1.2 110.31 177.787 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.554 HG22 ' HA2' ' A' ' 147' ' ' GLY . 45.5 mt -47.09 -52.79 4.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.446 -0.797 . . . . 0.32 111.662 174.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.626 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.3 mm-40 -59.83 -32.01 70.27 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.129 -0.487 . . . . 0.57 111.678 -178.169 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 13.4 mm-40 -64.5 -21.29 66.63 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.482 0.658 . . . . 0.78 110.767 177.576 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -112.68 6.37 18.2 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.212 -0.904 . . . . 0.93 110.786 -173.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 118.05 -46.69 1.11 Allowed Glycine 0 N--CA 1.442 -0.928 0 CA-C-N 115.501 -0.772 . . . . 0.56 113.099 173.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' GLY . . . . . 0.554 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 132.74 -171.68 21.58 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.322 -0.942 . . . . 0.49 112.476 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.446 ' NE1' HD13 ' A' ' 142' ' ' ILE . 19.7 m-90 -80.02 -45.92 17.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.96 0.409 . . . . 3.57 110.427 -178.057 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.444 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 18.9 t70 -56.86 -37.88 71.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.412 -0.813 . . . . 1.96 110.018 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.653 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 90.6 m -59.37 -36.65 76.15 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.346 -0.843 . . . . 0.67 111.384 178.468 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.605 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 62.6 t80 -63.63 -35.74 81.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.921 0.391 . . . . 3.0 110.493 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.603 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 0.7 OUTLIER -74.51 -25.3 19.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.463 0.649 . . . . 1.15 109.67 178.197 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 7.0 mm-40 -70.1 -26.54 64.03 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.736 -0.665 . . . . 1.67 109.383 173.555 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.653 ' HG ' ' O ' ' A' ' 150' ' ' THR . 12.1 mt -83.24 -58.63 2.76 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.545 -0.752 . . . . 1.3 110.338 177.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -114.51 -42.34 3.31 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.597 -0.274 . . . . 4.24 110.495 -175.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.57 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . 47.54 -156.01 0.94 Allowed Glycine 0 CA--C 1.506 -0.474 0 O-C-N 123.89 0.744 . . . . 1.1 114.037 -177.43 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.743 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 9.4 t30 . . . . . 0 N--CA 1.43 -1.456 0 CA-C-N 114.844 -0.678 . . . . 1.29 110.113 -176.061 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.464 0 N-CA-C 114.63 0.612 . . . . 1.2 114.63 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B 1006 ' ' ARG . . . . . 0.418 ' HA ' ' HD3' ' B' 1006 ' ' ARG . 31.8 mmt180 -105.71 -26.92 11.6 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.371 0.878 . . . . 2.88 113.371 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -78.68 -61.36 2.04 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.282 0.845 . . . . 1.31 113.282 -165.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.738 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 1.3 mm? -65.31 -44.65 87.2 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.734 -0.839 . . . . 1.33 108.734 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B 1009 ' ' ALA . . . . . 0.973 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -37.25 -52.03 1.05 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.512 -1.222 . . . . 0.88 110.855 169.612 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -76.75 -46.63 24.51 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 113.807 -1.542 . . . . 1.03 111.918 -174.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -68.67 -24.91 64.58 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.36 -0.382 . . . . 1.67 111.042 -178.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -72.72 -14.24 78.07 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.966 -0.561 . . . . 0.78 112.464 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 13.3 t70 -64.78 -20.26 66.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.345 0.593 . . . . 1.9 110.455 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 15.5 m . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 115.831 -0.622 . . . . 1.44 111.889 -177.324 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 . . . . . 0 C--O 1.226 -0.155 0 CA-C-O 121.088 0.47 . . . . 2.42 110.468 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 p -63.4 -23.5 67.43 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.623 -0.717 . . . . 1.25 112.028 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.909 ' HA ' HD22 ' A' ' 8' ' ' LEU . 73.1 m-20 -62.62 -28.18 69.73 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.308 0.575 . . . . 1.78 109.806 176.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.517 ' O ' HG23 ' A' ' 10' ' ' VAL . 7.0 tpp180 -60.64 -48.6 81.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.226 -0.897 . . . . 1.4 110.22 177.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -56.76 -51.45 68.86 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.392 -0.822 . . . . 0.68 111.209 -178.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.909 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.0 OUTLIER -47.62 -42.68 24.76 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.536 -0.756 . . . . 1.16 110.912 177.531 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.488 HG11 ' HA ' ' A' ' 127' ' ' ALA . 73.1 t -68.88 -63.7 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.46 -0.791 . . . . 0.27 110.195 176.295 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 6' ' ' ARG . 97.7 t -49.31 -53.68 8.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.416 -0.811 . . . . 0.33 112.979 -176.277 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -57.81 -34.09 69.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.007 0.432 . . . . 0.59 110.598 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.753 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.7 t80 -75.79 -46.52 30.25 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.111 -0.495 . . . . 1.61 110.671 -179.345 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 1.058 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.5 mp -59.87 -42.72 94.33 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 120.787 -0.365 . . . . 0.34 110.311 178.375 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.413 ' HA ' HD12 ' A' ' 17' ' ' LEU . 37.8 t -60.34 -38.89 85.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.951 -0.568 . . . . 1.05 110.47 178.225 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -71.33 -18.07 62.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.751 -0.659 . . . . 1.22 110.75 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.734 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 10.1 mmpt? -84.86 -46.36 11.4 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 121.368 0.604 . . . . 1.41 110.252 -179.16 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.757 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 14.6 mt -55.95 -26.92 50.11 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.125 -0.943 . . . . 1.35 111.276 177.105 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.6 t -58.55 -35.11 71.81 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.175 -0.921 . . . . 0.94 112.522 176.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.734 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 27.8 pt20 -80.43 -7.94 59.34 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.989 0.737 . . . . 1.37 112.989 -170.386 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 1.018 ' HZ2' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -111.93 -20.14 12.12 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 122.164 0.983 . . . . 2.2 109.238 178.545 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.09 28.1 6.29 Favored Glycine 0 C--N 1.306 -1.134 0 CA-C-N 113.652 -1.613 . . . . 0.53 112.741 174.034 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.545 ' HD1' ' HE3' ' A' ' 20' ' ' LYS . 70.8 m-85 -110.17 166.25 11.11 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.716 0.293 . . . . 0.76 110.83 172.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.514 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 4.0 t -110.62 154.98 23.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.341 -0.391 . . . . 0.52 110.554 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.571 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 68.0 t-105 -72.64 -54.5 8.88 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.101 -0.5 . . . . 3.36 110.252 174.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.4 t -62.38 -27.52 69.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.699 -0.682 . . . . 1.37 111.776 -173.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.514 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 95.3 mt-30 -59.26 -26.6 65.06 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 111.898 0.333 . . . . 1.11 111.898 178.652 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -119.94 -10.73 9.42 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.086 0.402 . . . . 1.28 112.086 -173.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.548 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 49.3 m -101.89 179.53 4.3 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 113.627 0.973 . . . . 1.81 113.627 -169.78 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.437 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 0.8 OUTLIER -156.08 -14.26 0.1 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.376 -1.284 . . . . 2.31 110.015 -179.015 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.905 HG23 ' H ' ' A' ' 31' ' ' GLU . 12.3 m -51.95 -71.56 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.479 -1.237 . . . . 0.92 112.76 -169.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.905 ' H ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -99.9 1.22 42.61 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-O 121.54 0.686 . . . . 2.74 109.672 177.844 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.437 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.5 tt0 . . . . . 0 N--CA 1.446 -0.655 0 CA-C-N 114.697 -1.138 . . . . 1.45 111.157 -178.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.798 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.6 OUTLIER . . . . . 0 CA--C 1.541 0.6 0 CA-C-O 120.89 0.376 . . . . 1.12 110.46 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.798 ' H ' HG23 ' A' ' 41' ' ' THR . 15.4 pt-20 -93.53 -27.82 16.42 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-O 123.176 1.465 . . . . 2.02 107.908 166.428 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.503 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.1 OUTLIER -66.83 -20.92 66.03 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 111.676 -2.511 . . . . 1.25 113.954 -167.577 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 35.5 tt0 -54.89 -59.84 4.18 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.933 -0.307 . . . . 1.91 111.012 -179.201 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.465 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -64.58 -36.35 83.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.223 0.535 . . . . 0.52 110.034 179.195 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.566 ' HA ' HG12 ' A' ' 152' ' ' VAL . 99.4 t -59.5 -60.74 2.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 114.917 -1.038 . . . . 1.41 111.14 178.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.485 ' HB3' HD12 ' A' ' 8' ' ' LEU . 11.2 ptpt -62.42 -35.13 78.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.624 0.726 . . . . 0.67 109.255 -176.862 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.591 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 41.4 mm-40 -65.95 -32.31 73.73 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.941 -1.027 . . . . 0.99 110.826 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.695 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -74.5 -43.88 53.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.13 0.49 . . . . 0.42 110.624 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.474 ' O ' ' HE2' ' A' ' 12' ' ' PHE . 8.0 mp -63.25 -26.54 68.83 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.429 -0.805 . . . . 1.33 112.88 -174.367 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.522 ' HD3' ' OE1' ' A' ' 48' ' ' GLN . 10.4 ptm180 -78.51 -32.41 48.09 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.156 -1.053 . . . . 2.17 108.156 -175.422 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 3.7 mm-40 -80.41 -44.19 19.75 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 113.565 -1.652 . . . . 1.1 109.907 -179.704 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.29 -41.08 98.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.486 -0.779 . . . . 0.53 110.169 175.129 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.729 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.16 -42.23 98.49 Favored Glycine 0 C--O 1.22 -0.759 0 CA-C-N 115.558 -0.746 . . . . 0.7 112.001 177.568 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.59 ' O ' HD22 ' A' ' 59' ' ' LEU . 29.8 t70 -53.46 -37.78 62.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.948 0.404 . . . . 1.04 111.296 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -71.93 -24.92 61.71 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.729 -0.669 . . . . 2.29 111.863 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -84.01 -44.62 13.96 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 112.103 0.408 . . . . 2.29 112.103 174.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.729 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.3 mt-10 -66.02 -46.27 78.48 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.111 0.782 . . . . 1.3 113.111 -164.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.59 HD22 ' O ' ' A' ' 55' ' ' ASP . 2.5 pt? -53.46 -31.22 44.62 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.014 -0.539 . . . . 1.54 111.347 -173.704 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 67.2 mtt-85 -64.93 -53.71 42.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.549 -0.75 . . . . 2.58 111.741 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.719 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 15.3 p90 -90.76 -3.8 57.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.595 -0.275 . . . . 5.32 111.119 -176.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.4 ttt180 -53.59 -34.87 59.93 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.469 0.544 . . . . 4.48 112.469 -172.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -64.77 -33.88 77.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.992 0.425 . . . . 4.72 110.761 177.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.582 ' HB1' HD13 ' A' ' 68' ' ' LEU . . . -78.37 -28.91 47.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.891 -0.595 . . . . 1.17 110.577 -178.511 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.573 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 52.7 t80 -44.3 -46.91 9.42 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.543 0.572 . . . . 2.81 112.543 -176.415 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 36.7 t -62.76 -44.68 95.55 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.894 0.378 . . . . 2.19 110.744 -177.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.75 -29.12 40.43 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.104 -0.498 . . . . 2.72 111.549 -176.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.727 ' HA ' ' HG3' ' A' ' 71' ' ' GLN . 4.1 mp -61.6 -24.37 66.64 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.677 0.621 . . . . 1.56 112.677 -175.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.475 HG22 HG13 ' A' ' 74' ' ' ILE . 21.2 p -57.73 -29.13 64.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.171 0.51 . . . . 0.7 110.719 178.479 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.5 t -76.8 -38.87 53.17 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.566 -0.743 . . . . 1.34 109.768 176.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.727 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 24.8 mt-30 -65.63 -47.17 76.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.32 -0.854 . . . . 1.42 110.161 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.602 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.2 mt -74.8 -31.4 61.72 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.753 -0.658 . . . . 1.37 110.545 178.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.468 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 49.2 m80 71.86 54.64 0.19 Allowed 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.563 0.697 . . . . 2.72 109.276 -176.436 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.478 HG21 ' HB3' ' A' ' 113' ' ' GLU . 15.2 mm -58.58 118.47 2.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 114.165 -1.379 . . . . 0.91 110.666 -179.732 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.758 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -156.39 -170.41 0.24 Allowed Pre-proline 0 CA--C 1.546 0.827 0 N-CA-C 107.98 -1.118 . . . . 0.51 107.98 -169.214 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.758 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 38.4 Cg_exo -29.47 166.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.278 0 C-N-CA 124.814 3.676 . . . . 0.47 115.091 163.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -33.24 -24.08 0.01 OUTLIER Glycine 0 N--CA 1.471 1.0 0 N-CA-C 117.259 1.664 . . . . 0.4 117.259 -174.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.453 ' N ' ' O ' ' A' ' 76' ' ' PRO . 17.2 p -71.96 6.3 2.17 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 117.994 0.897 . . . . 0.56 112.216 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.57 -12.64 61.56 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.165 0.507 . . . . 0.34 110.19 174.349 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.453 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 1.8 p90 -76.0 -15.13 60.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.013 -0.539 . . . . 4.13 109.841 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.472 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 36.3 mt-30 -83.38 -26.31 30.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.451 -0.795 . . . . 1.03 109.793 173.128 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.544 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.2 m -74.48 -50.12 19.56 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.041 -0.981 . . . . 0.48 109.392 172.373 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -65.54 -18.29 65.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.991 -1.004 . . . . 1.18 110.06 175.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.574 ' HA ' HG12 ' A' ' 87' ' ' VAL . 37.9 tt0 -62.84 -49.02 76.54 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.258 -0.883 . . . . 0.8 110.57 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.409 ' O ' ' HG2' ' A' ' 89' ' ' GLU . 73.5 mt-30 -48.1 -36.43 13.2 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.716 -1.129 . . . . 1.62 110.125 177.594 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.79 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.0 OUTLIER -81.37 -54.58 9.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 114.452 -1.249 . . . . 1.3 111.026 -176.108 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.574 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.6 p -59.33 -23.45 25.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 122.038 0.923 . . . . 0.85 109.396 -177.105 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.7 m-80 -71.31 -58.46 3.51 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 113.945 -1.48 . . . . 0.91 110.894 172.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 1.028 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.0 OUTLIER -62.26 -38.8 90.69 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-O 121.967 0.889 . . . . 2.87 109.358 -174.396 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' A' ' 86' ' ' VAL . 1.7 tp -56.12 -30.55 62.25 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 113.194 -1.821 . . . . 1.28 110.912 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.574 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 71.6 t80 -94.35 -33.38 13.2 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.488 -0.324 . . . . 2.3 111.839 -168.63 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.91 -45.99 47.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 122.119 0.961 . . . . 5.06 110.213 -175.286 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -95.82 20.63 9.61 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 113.803 -1.544 . . . . 3.12 112.568 -159.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.473 ' O ' ' HG2' ' A' ' 99' ' ' ARG . . . 130.16 68.56 0.11 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 118.141 -1.981 . . . . 2.31 115.757 174.114 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.66 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 61.2 t -73.04 98.71 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 118.593 1.196 . . . . 1.06 110.23 173.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.598 ' ND2' ' HB3' ' A' ' 99' ' ' ARG . 3.3 p30 -111.98 -174.46 2.47 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.537 -1.21 . . . . 2.12 109.24 175.271 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.643 ' HA ' ' CE2' ' A' ' 151' ' ' PHE . 16.1 m-90 -61.68 -45.62 93.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.979 -0.555 . . . . 3.34 110.856 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.42 ' O ' HG13 ' A' ' 101' ' ' VAL . . . -77.43 -37.0 32.46 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.905 -0.589 . . . . 0.69 113.456 -174.204 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.67 ' NH2' HD11 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -64.83 -29.14 70.09 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 122.433 -0.451 . . . . 4.24 110.524 -177.168 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.563 HG22 ' HE1' ' A' ' 104' ' ' PHE . 45.4 mt -68.58 -36.91 76.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 C-N-CA 120.231 -0.587 . . . . 0.44 110.314 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.42 HG13 ' O ' ' A' ' 98' ' ' GLY . 0.6 OUTLIER -59.46 -31.46 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 109.562 -0.532 . . . . 1.35 109.562 175.946 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 99' ' ' ARG . . . -65.74 -35.36 80.5 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.837 -0.62 . . . . 0.44 111.06 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.464 ' HB3' ' O ' ' A' ' 100' ' ' ILE . 17.4 t80 -60.95 -32.78 72.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.114 -0.948 . . . . 1.49 109.95 177.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.721 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 89.1 m-85 -80.27 -35.94 35.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.945 -0.57 . . . . 3.29 110.4 175.091 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.753 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 20.0 m -61.44 -53.58 54.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.082 -0.508 . . . . 1.19 110.658 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.553 ' HZ ' HD11 ' A' ' 72' ' ' LEU . 32.2 t80 -73.46 -33.61 64.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.06 -0.518 . . . . 2.89 110.392 -178.588 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.474 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -67.93 -44.83 77.29 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.974 -0.631 . . . . 0.3 111.835 178.476 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 1.058 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.22 -31.67 81.37 Favored Glycine 0 N--CA 1.442 -0.914 0 N-CA-C 111.097 -0.801 . . . . 0.23 111.097 175.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.573 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -68.52 -34.77 76.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.304 -0.448 . . . . 0.31 109.887 176.514 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.455 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.2 OUTLIER -64.2 -35.63 81.44 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.909 0.861 . . . . 1.12 110.169 -178.52 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.721 ' SG ' HD21 ' A' ' 17' ' ' LEU . 41.4 t -52.55 -49.16 65.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.51 -1.223 . . . . 0.26 109.478 172.546 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 1.018 HG13 ' HZ2' ' A' ' 20' ' ' LYS . 94.5 t -64.59 -37.15 79.32 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 CA-C-N 116.272 -0.422 . . . . 0.35 110.557 175.529 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.478 ' HB3' HG21 ' A' ' 74' ' ' ILE . 46.5 mt-10 -56.44 -34.85 67.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.96 0.41 . . . . 2.51 110.965 176.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.419 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 26.6 m -79.34 -36.75 38.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.366 0.603 . . . . 0.28 109.715 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.679 HG23 ' O ' ' A' ' 111' ' ' CYS . 98.1 t -69.34 -32.19 52.46 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.993 0.902 . . . . 1.23 109.427 -178.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -56.83 -50.05 73.56 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.596 -1.638 . . . . 0.6 111.302 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 35.9 mmtt -85.87 13.8 6.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.795 -0.639 . . . . 1.62 110.608 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 62.16 48.45 4.97 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.626 0.727 . . . . 1.88 110.497 -178.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 31.4 mtm -126.67 44.09 2.96 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.909 -1.145 . . . . 0.31 107.909 -178.306 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.629 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 12.4 mp0 -61.75 -6.99 2.99 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.927 -1.033 . . . . 1.15 113.31 -171.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.511 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 34.2 m -65.55 -25.32 36.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 120.771 0.32 . . . . 0.46 111.029 176.649 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.626 HD13 ' HD2' ' A' ' 125' ' ' ARG . 2.9 mm? -73.89 -25.3 59.95 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 116.563 -0.289 . . . . 0.26 110.556 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.714 HG13 ' SG ' ' A' ' 111' ' ' CYS . 53.2 t -44.13 -53.12 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 O-C-N 123.63 0.581 . . . . 0.25 112.211 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.548 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 6.4 t -78.32 -22.2 48.48 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.097 0.475 . . . . 1.35 110.687 -177.424 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.626 ' HD2' HD13 ' A' ' 122' ' ' LEU . 75.1 mtt180 -79.33 -44.87 20.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.093 -0.503 . . . . 2.67 110.897 -177.81 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.679 ' HA ' ' CE3' ' A' ' 129' ' ' TRP . 85.6 mt -56.15 -47.46 80.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.838 -0.619 . . . . 0.23 110.781 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.571 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -59.2 -35.95 74.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.818 0.342 . . . . 0.29 111.024 178.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -58.1 -58.72 7.17 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.58 0.705 . . . . 0.28 110.383 175.769 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.679 ' CE3' ' HA ' ' A' ' 126' ' ' ILE . 16.6 m0 -56.12 -48.46 76.16 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.22 -1.354 . . . . 3.91 110.32 -178.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.541 ' SD ' HG22 ' A' ' 126' ' ' ILE . 91.3 mtp -59.06 -55.02 40.49 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.658 -0.701 . . . . 1.08 111.787 -176.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.22 -38.66 87.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.137 -0.483 . . . . 0.25 111.42 -177.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 47.8 m -65.66 -47.21 76.28 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.73 -0.388 . . . . 0.4 110.7 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.627 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 5.5 m-85 -56.36 -36.06 68.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.3 -0.409 . . . . 3.13 110.529 177.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.847 HD13 ' HB3' ' A' ' 5' ' ' ASN . 4.2 tt -62.28 -58.38 7.92 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.786 -0.82 . . . . 0.95 108.786 170.522 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -48.38 -45.66 36.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.338 -0.846 . . . . 0.46 112.842 -176.302 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -88.96 -45.81 9.38 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.056 0.391 . . . . 0.59 112.056 -175.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' HIS . . . . . 0.627 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 31.0 m-70 -91.25 -48.98 6.62 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.414 0.524 . . . . 1.45 112.414 -170.15 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.764 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -88.52 -44.24 10.82 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 113.819 1.044 . . . . 1.2 113.819 -168.603 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.62 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 34.8 tt0 -43.44 -53.15 12.09 Favored Pre-proline 0 C--N 1.323 -0.566 0 O-C-N 123.831 0.707 . . . . 0.75 112.8 -174.703 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.654 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 10.8 Cg_endo -54.37 -49.44 16.92 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 121.857 1.705 . . . . 0.56 111.574 177.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 5.0 t-105 -55.99 -52.99 62.22 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.556 -0.747 . . . . 1.2 110.341 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.57 HD12 ' HA ' ' A' ' 139' ' ' GLU . 43.6 mt -46.55 -52.29 3.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.804 -0.634 . . . . 0.32 111.812 176.706 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.62 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.8 mm-40 -60.25 -32.09 70.82 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.766 -0.652 . . . . 0.57 111.782 -179.267 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.654 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.6 mm-40 -65.44 -21.43 66.65 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 121.659 0.742 . . . . 0.78 110.464 177.542 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -107.87 9.57 28.77 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.019 -0.991 . . . . 0.93 110.016 -174.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 121.46 -29.37 5.7 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.902 -1.045 . . . . 0.56 113.38 171.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 108.64 166.11 20.89 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.649 -0.786 . . . . 0.49 111.227 -175.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.786 ' HZ2' HD11 ' A' ' 134' ' ' LEU . 16.9 m95 -57.16 -40.39 77.15 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.82 0.674 . . . . 3.57 112.82 -174.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.534 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 9.9 m-20 -55.35 -41.61 72.76 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.303 -0.258 . . . . 1.96 110.303 177.693 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.606 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 23.4 m -56.58 -38.55 72.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.234 -0.439 . . . . 0.67 111.508 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.643 ' CE2' ' HA ' ' A' ' 97' ' ' TRP . 1.2 m-85 -61.29 -36.77 81.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.543 0.687 . . . . 3.0 109.44 -178.561 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.566 HG12 ' HA ' ' A' ' 46' ' ' VAL . 0.7 OUTLIER -80.32 -25.41 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 115.382 -0.827 . . . . 1.15 110.042 178.115 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 6.6 mm-40 -64.56 -29.73 70.75 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.135 0.493 . . . . 1.67 109.902 173.83 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 150' ' ' THR . 9.5 mt -82.96 -56.44 3.81 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.633 -0.712 . . . . 1.3 110.164 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 155' ' ' TYR . . . . . 0.429 ' HE2' ' HB2' ' A' ' 52' ' ' GLU . 62.5 t80 -113.48 -44.93 3.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.296 -0.411 . . . . 4.24 110.752 -176.362 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.695 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . 43.36 -157.15 0.12 Allowed Glycine 0 CA--C 1.502 -0.746 0 CA-C-O 121.769 0.65 . . . . 1.1 113.829 -177.179 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.591 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 6.0 t30 . . . . . 0 N--CA 1.426 -1.636 0 CA-C-N 114.776 -0.712 . . . . 1.29 109.745 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1005 ' ' GLY . . . . . 0.936 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 N--CA 1.439 -1.165 0 N-CA-C 110.366 -1.094 . . . . 1.2 110.366 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -121.46 -32.29 3.87 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.952 0.501 . . . . 2.88 111.878 174.713 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -82.26 -54.14 5.48 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.256 -0.429 . . . . 1.31 112.114 -167.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.567 HD22 ' H ' ' B' 1008 ' ' LEU . 2.2 mm? -70.03 -31.69 69.45 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.076 -0.713 . . . . 1.33 109.076 -177.403 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B 1009 ' ' ALA . . . . . 1.028 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -49.89 -45.34 50.66 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.367 -1.288 . . . . 0.88 109.782 172.517 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -85.23 -49.41 8.22 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 113.178 -1.828 . . . . 1.03 111.498 -174.1 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -65.58 -23.56 66.87 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.048 -0.524 . . . . 1.67 110.498 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.82 -11.35 83.52 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.932 -0.576 . . . . 0.78 112.934 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 32.6 t70 -71.84 -15.43 62.13 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.5 0.667 . . . . 1.9 109.654 170.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.45 -0.436 0 CA-C-N 115.553 -0.749 . . . . 1.44 110.223 -178.723 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 . . . . . 0 CA--C 1.529 0.15 0 CA-C-O 120.917 0.389 . . . . 2.42 111.072 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m -82.13 -17.92 44.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.167 -0.469 . . . . 1.25 111.068 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.767 ' HA ' HD22 ' A' ' 8' ' ' LEU . 76.2 m-20 -62.64 -22.1 66.18 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 121.218 0.532 . . . . 1.78 109.756 177.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.547 ' HA ' ' CB ' ' A' ' 131' ' ' ALA . 11.7 tpp85 -57.78 -43.53 85.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.276 -0.875 . . . . 1.4 110.573 176.57 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -61.58 -49.16 77.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.71 -0.677 . . . . 0.68 111.242 -177.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.767 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.3 OUTLIER -50.04 -32.99 16.83 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.129 -0.942 . . . . 1.16 111.383 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.449 HG11 ' HA ' ' A' ' 127' ' ' ALA . 79.5 t -79.53 -62.25 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.79 -0.641 . . . . 0.27 110.24 173.179 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.532 HG13 ' CE2' ' A' ' 24' ' ' TRP . 73.2 t -48.58 -54.73 4.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.504 -0.771 . . . . 0.33 112.553 -176.159 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -57.08 -37.49 71.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.094 -0.503 . . . . 0.59 110.524 -177.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.744 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 19.2 t80 -69.8 -46.49 65.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.939 -0.573 . . . . 1.61 110.501 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 1.056 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.9 mp -62.01 -39.48 92.39 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 120.98 -0.288 . . . . 0.34 110.45 178.296 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.3 m -58.63 -42.21 87.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.395 0.617 . . . . 1.05 110.205 176.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -67.47 -17.84 64.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.108 -0.951 . . . . 1.22 111.108 -178.259 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.632 ' HE2' ' HA ' ' A' ' 16' ' ' LYS . 10.4 mmpt? -85.96 -49.1 8.1 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.525 0.679 . . . . 1.41 109.777 -178.299 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.582 HD21 ' SG ' ' A' ' 111' ' ' CYS . 12.4 mt -59.33 -28.31 66.7 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.965 -1.016 . . . . 1.35 111.26 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.3 t -56.82 -43.88 81.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.427 -0.806 . . . . 0.94 111.678 177.197 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 12.4 pt20 -80.64 2.02 27.53 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.995 0.426 . . . . 1.37 111.587 -178.418 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.764 ' HE2' HG11 ' A' ' 112' ' ' VAL . 20.7 mmmt -107.39 -28.54 9.79 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.913 0.863 . . . . 2.2 109.032 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 22.25 10.4 Favored Glycine 0 N--CA 1.441 -0.999 0 CA-C-N 113.888 -1.505 . . . . 0.53 111.576 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -113.61 161.73 17.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.862 0.363 . . . . 0.76 110.691 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.3 t -102.33 145.94 28.75 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.998 -0.546 . . . . 0.52 110.259 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.532 ' CE2' HG13 ' A' ' 10' ' ' VAL . 48.2 t-105 -75.09 -51.77 12.68 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.598 -0.728 . . . . 3.36 109.192 174.471 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.407 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 4.8 m -60.01 -34.48 73.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.378 -0.828 . . . . 1.37 111.976 -174.239 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -61.45 -28.78 69.52 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.781 0.325 . . . . 1.11 111.536 -179.075 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -120.85 19.06 11.8 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.192 -0.458 . . . . 1.28 111.253 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.545 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 53.7 p -99.81 -178.72 3.95 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.592 0.71 . . . . 1.81 112.034 -172.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.527 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.0 OUTLIER -165.43 -25.69 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.429 -1.26 . . . . 2.31 109.304 -179.364 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.915 HG23 ' H ' ' A' ' 31' ' ' GLU . 10.7 m -50.63 -71.89 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 114.387 -1.279 . . . . 0.92 112.864 -173.623 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.915 ' H ' HG23 ' A' ' 30' ' ' VAL . 9.0 pt-20 -94.82 0.38 54.82 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.929 -0.767 . . . . 2.74 108.929 177.69 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.527 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 30.5 tt0 . . . . . 0 N--CA 1.446 -0.663 0 CA-C-N 114.671 -1.15 . . . . 1.45 110.577 -178.008 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.645 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.5 OUTLIER . . . . . 0 CA--C 1.537 0.445 0 CA-C-O 120.366 0.127 . . . . 1.12 110.757 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.645 ' H ' HG23 ' A' ' 41' ' ' THR . 0.0 OUTLIER -91.85 -35.36 14.12 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 121.717 0.77 . . . . 2.02 109.486 172.883 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.745 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 27.9 p -54.42 -36.96 64.55 Favored 'General case' 0 C--O 1.212 -0.886 0 CA-C-N 114.19 -1.368 . . . . 1.25 113.122 -171.044 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -42.6 -40.49 2.71 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.694 0.627 . . . . 1.91 112.694 -171.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.582 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -87.51 -36.18 17.78 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 121.926 -0.484 . . . . 0.52 111.543 178.55 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.697 HG13 ' HA ' ' A' ' 43' ' ' SER . 0.7 OUTLIER -72.63 -37.07 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.894 -0.139 . . . . 1.41 111.18 -177.801 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.745 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.8 ptpt -67.15 -40.22 86.66 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.018 -0.734 . . . . 0.67 109.018 175.724 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.62 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 33.0 mm-40 -63.28 -34.62 78.07 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.317 -0.856 . . . . 0.99 110.953 176.118 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.51 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -72.67 -38.21 67.67 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.192 0.52 . . . . 0.42 110.841 178.587 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 mp -69.96 -23.88 63.25 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.624 -0.716 . . . . 1.33 112.508 -174.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.449 ' HD2' ' OE1' ' A' ' 48' ' ' GLN . 9.3 ptp180 -84.92 -25.49 27.87 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.95 0.881 . . . . 2.17 109.054 -175.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.62 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 10.7 mm-40 -78.05 -45.34 23.86 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.233 -1.349 . . . . 1.1 110.202 176.626 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.03 -40.57 91.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.005 -0.543 . . . . 0.53 110.129 174.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.737 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.35 -41.0 98.27 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.778 -0.646 . . . . 0.7 112.03 178.549 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.469 ' O ' HD22 ' A' ' 59' ' ' LEU . 19.6 t70 -55.09 -35.31 64.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.984 0.421 . . . . 1.04 110.767 -179.458 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.449 ' O ' HD21 ' A' ' 59' ' ' LEU . 29.4 mm-40 -73.3 -25.96 60.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.337 -0.847 . . . . 2.29 111.898 179.266 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.463 ' HE1' ' HA2' ' B' 1012 ' ' GLY . 66.2 t80 -83.51 -33.31 25.56 Favored 'General case' 0 C--N 1.316 -0.858 0 O-C-N 122.205 -0.309 . . . . 2.29 111.703 177.582 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.737 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 39.6 mt-10 -66.34 -54.02 29.41 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.575 0.583 . . . . 1.3 112.575 -167.215 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.562 HD23 ' N ' ' A' ' 59' ' ' LEU . 2.1 pt? -53.75 -36.67 62.58 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.696 -0.684 . . . . 1.54 110.775 -176.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 64.9 mtt180 -52.94 -55.65 21.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.54 -0.754 . . . . 2.58 111.717 -178.752 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.638 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 47.9 p90 -90.72 -4.5 56.66 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 121.134 -0.227 . . . . 5.32 111.119 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 53.3 ttp180 -54.34 -30.4 51.37 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 122.769 0.428 . . . . 4.48 111.646 -177.553 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.585 ' HD2' ' H ' ' A' ' 63' ' ' ARG . 3.3 mpt_? -66.54 -35.28 79.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.987 0.422 . . . . 4.72 110.641 179.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.538 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.35 -27.57 17.46 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.051 -0.522 . . . . 1.17 111.991 -179.107 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.58 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 51.6 t80 -41.67 -48.54 4.15 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.184 1.179 . . . . 2.81 114.184 -169.425 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.3 t -63.91 -44.25 93.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.932 0.396 . . . . 2.19 110.682 -173.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -72.63 -32.57 66.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.97 -0.559 . . . . 2.72 111.067 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 14.5 mt -58.87 -23.53 61.03 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 112.929 0.714 . . . . 1.56 112.929 -174.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.444 HG22 HG13 ' A' ' 74' ' ' ILE . 16.9 p -57.39 -26.27 60.82 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 118.33 0.514 . . . . 0.7 111.217 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -73.35 -24.81 60.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.712 -0.676 . . . . 1.34 109.938 177.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.429 ' OE1' HD22 ' A' ' 68' ' ' LEU . 61.1 mt-30 -87.41 -40.06 14.72 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.456 -0.793 . . . . 1.42 110.163 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.652 HD21 ' HZ ' ' A' ' 106' ' ' PHE . 3.3 mm? -65.56 -32.55 74.21 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.746 -0.465 . . . . 1.37 109.746 173.17 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 72.7 t60 66.33 44.33 2.48 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 107.673 -1.232 . . . . 2.72 107.673 -173.595 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.598 HG22 ' HE1' ' A' ' 119' ' ' MET . 26.3 mm -51.35 118.33 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 113.759 -1.564 . . . . 0.91 111.541 -179.507 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.773 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.32 -171.82 0.3 Allowed Pre-proline 0 C--N 1.316 -0.877 0 N-CA-C 107.301 -1.37 . . . . 0.51 107.301 -170.838 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.773 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 39.2 Cg_exo -29.07 165.36 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 125.07 3.847 . . . . 0.47 115.576 165.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.43 -28.53 0.01 OUTLIER Glycine 0 N--CA 1.475 1.279 0 N-CA-C 117.826 1.891 . . . . 0.4 117.826 -172.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.45 ' N ' ' O ' ' A' ' 76' ' ' PRO . 35.1 p -69.13 6.92 0.83 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 118.21 1.005 . . . . 0.56 112.476 -179.172 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.81 -11.84 60.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.244 0.545 . . . . 0.34 110.192 174.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -76.52 -18.06 58.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.961 -0.563 . . . . 4.13 109.673 175.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.431 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 32.8 mt-30 -84.27 -24.22 30.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.895 0.855 . . . . 1.03 109.329 173.498 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.5 m -71.48 -50.46 31.38 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.542 -1.208 . . . . 0.48 109.23 170.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -67.85 -18.69 64.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.252 -0.886 . . . . 1.18 110.167 175.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.585 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.7 tt0 -59.73 -52.17 66.63 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-O 121.605 0.717 . . . . 0.8 110.026 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.427 ' O ' ' HG2' ' A' ' 89' ' ' GLU . 57.4 mm-40 -47.47 -35.07 8.12 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.707 -1.588 . . . . 1.62 110.781 177.428 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.861 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -86.36 -49.76 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 CA-C-N 114.519 -1.219 . . . . 1.3 111.054 -175.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.585 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.7 p -62.81 -22.72 31.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.979 0.895 . . . . 0.85 109.361 -178.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.606 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 2.6 m-80 -71.08 -52.21 20.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.306 -1.315 . . . . 0.91 111.146 174.225 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 1.028 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.0 OUTLIER -67.51 -38.22 83.98 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-O 121.754 0.787 . . . . 2.87 109.346 -177.039 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.463 ' HG ' ' OE2' ' A' ' 89' ' ' GLU . 18.2 mt -63.01 -24.87 68.12 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 113.867 -1.515 . . . . 1.28 111.46 -178.319 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.651 ' HA ' HG22 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -110.27 -40.61 4.63 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 112.588 0.588 . . . . 2.3 112.588 -170.558 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.606 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER -67.8 -29.83 69.11 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.316 0.579 . . . . 5.06 110.784 -171.318 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.528 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 1.2 m-20 -98.88 17.22 20.05 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.353 -0.84 . . . . 3.12 112.972 -172.483 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.594 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 126.38 71.75 0.19 Allowed Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 117.18 -2.438 . . . . 2.31 115.758 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.651 HG22 ' HA ' ' A' ' 91' ' ' PHE . 57.8 t -71.42 102.73 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-N 118.977 1.388 . . . . 1.06 110.698 177.022 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -112.16 -172.53 2.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.848 -1.069 . . . . 2.12 110.143 -178.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.703 ' HD1' ' HB3' ' A' ' 145' ' ' ASN . 74.0 t90 -51.46 -49.43 61.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.408 -0.814 . . . . 3.34 111.799 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -86.36 -14.42 66.22 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 120.775 -0.726 . . . . 0.69 114.04 -174.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 94' ' ' GLY . 24.9 mmt180 -64.17 -45.01 90.27 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 117.459 0.63 . . . . 4.24 111.398 -176.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.643 ' HA ' ' CD1' ' A' ' 103' ' ' PHE . 66.7 mt -60.0 -30.83 46.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.51 -0.768 . . . . 0.44 111.542 -174.397 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 36.3 t -56.58 -54.63 26.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.653 -0.703 . . . . 1.35 110.384 171.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.78 -40.99 63.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.304 -0.862 . . . . 0.44 111.875 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.643 ' CD1' ' HA ' ' A' ' 100' ' ' ILE . 68.1 m-85 -50.42 -56.69 10.33 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.311 0.577 . . . . 1.49 110.56 177.009 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.634 ' HD1' ' HE3' ' A' ' 130' ' ' MET . 17.7 m-85 -75.57 -27.4 58.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.546 -0.752 . . . . 3.29 111.178 -174.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.744 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 47.2 m -62.81 -46.36 88.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.863 0.364 . . . . 1.19 110.452 178.308 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.652 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 56.5 t80 -80.84 -32.36 35.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.232 -0.44 . . . . 2.89 110.483 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.781 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.93 -40.42 95.37 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.64 -0.791 . . . . 0.3 111.9 176.264 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 1.056 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.51 -31.0 75.59 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 111.152 -0.779 . . . . 0.23 111.152 174.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.58 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -72.42 -32.66 66.52 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 110.02 -0.363 . . . . 0.31 110.02 176.142 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.433 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.2 OUTLIER -65.66 -36.23 83.06 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.833 0.825 . . . . 1.12 110.123 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.738 ' HB2' HD23 ' A' ' 13' ' ' LEU . 35.8 t -50.55 -48.01 57.51 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 114.468 -1.242 . . . . 0.26 109.233 172.06 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.764 HG11 ' HE2' ' A' ' 20' ' ' LYS . 92.3 t -71.04 -32.64 48.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.599 -0.728 . . . . 0.35 110.879 177.674 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.433 ' OE2' ' HA ' ' A' ' 110' ' ' LEU . 40.0 mt-10 -57.27 -34.46 68.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.26 0.552 . . . . 2.51 110.223 174.489 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.459 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 16.6 m -77.21 -35.06 55.97 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 115.682 -0.69 . . . . 0.28 109.312 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 111' ' ' CYS . 86.9 t -69.04 -35.21 67.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 121.91 0.862 . . . . 1.23 109.344 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -53.49 -49.28 67.84 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 113.547 -1.66 . . . . 0.6 111.374 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -88.15 13.09 12.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.856 -0.611 . . . . 1.62 110.387 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 61.09 52.34 4.06 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.723 0.773 . . . . 1.88 110.335 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.598 ' HE1' HG22 ' A' ' 74' ' ' ILE . 28.7 mtm -130.96 44.37 2.97 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 107.781 -1.192 . . . . 0.31 107.781 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.659 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 15.1 mp0 -60.02 -6.66 1.43 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.746 -1.116 . . . . 1.15 113.465 -172.739 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.559 HG23 HD22 ' A' ' 122' ' ' LEU . 31.4 m -65.96 -26.63 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 121.943 -0.473 . . . . 0.46 111.553 175.615 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.722 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.1 mm? -71.85 -27.13 62.68 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 110.373 -0.232 . . . . 0.26 110.373 -179.11 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.707 HG13 ' SG ' ' A' ' 111' ' ' CYS . 41.0 t -39.07 -55.56 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 O-C-N 124.33 1.019 . . . . 0.25 112.736 177.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.545 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 5.7 t -77.9 -30.54 50.71 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.642 -0.423 . . . . 1.35 110.773 -177.501 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.722 ' HD2' HD13 ' A' ' 122' ' ' LEU . 88.0 mtt180 -66.57 -48.78 68.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.204 -0.453 . . . . 2.67 110.997 -176.538 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.451 HD12 ' HA ' ' A' ' 111' ' ' CYS . 75.3 mt -53.66 -49.9 53.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.731 -0.668 . . . . 0.23 110.874 178.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.556 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.53 -36.99 69.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.996 -0.547 . . . . 0.29 112.046 -178.746 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.13 -57.85 10.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.459 0.647 . . . . 0.28 110.91 178.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -65.5 -37.32 86.45 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.695 -1.139 . . . . 3.91 111.02 -176.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.781 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 0.4 OUTLIER -61.9 -48.63 79.58 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.034 0.445 . . . . 1.08 111.091 179.712 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.547 ' CB ' ' HA ' ' A' ' 6' ' ' ARG . . . -67.75 -37.81 82.63 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 0.25 111.227 -178.059 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 96.9 m -65.57 -45.62 82.59 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.794 -0.363 . . . . 0.4 110.982 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.42 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 49.1 t80 -56.47 -43.36 79.53 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.554 -0.536 . . . . 3.13 109.554 177.236 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.985 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.4 OUTLIER -54.9 -61.33 2.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.764 -0.653 . . . . 0.95 109.786 170.992 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ASN . . . . . 0.404 ' HA ' HD22 ' A' ' 5' ' ' ASN . 4.8 m-80 -43.9 -56.17 4.08 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.3 -0.864 . . . . 0.46 112.808 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -76.94 -51.37 11.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.117 0.484 . . . . 0.59 111.925 -174.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' HIS . . . . . 0.42 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 0.4 OUTLIER -92.0 -51.56 5.14 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.982 0.734 . . . . 1.45 112.982 -170.261 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.985 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -79.51 -42.18 25.77 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 114.492 1.293 . . . . 1.2 114.492 -165.718 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.532 ' HB3' ' HD3' ' A' ' 140' ' ' PRO . 29.2 tt0 -44.09 -48.99 23.21 Favored Pre-proline 0 N--CA 1.472 0.643 0 N-CA-C 112.906 0.706 . . . . 0.75 112.906 -174.137 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.585 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.0 Cg_exo -52.91 -46.77 31.46 Favored 'Trans proline' 0 C--N 1.356 0.957 0 C-N-CA 121.949 1.766 . . . . 0.56 111.952 175.321 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -48.84 78.71 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.801 -0.636 . . . . 1.2 110.921 178.53 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.553 HD12 ' O ' ' A' ' 138' ' ' LEU . 1.7 mp -49.73 -47.75 21.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.142 0.496 . . . . 0.32 110.694 177.124 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.509 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 70.8 mm-40 -64.44 -29.59 70.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.538 -0.756 . . . . 0.57 111.991 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 19.1 mm-40 -62.15 -24.13 66.99 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.784 0.802 . . . . 0.78 110.006 176.007 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 145' ' ' ASN . . . . . 0.703 ' HB3' ' HD1' ' A' ' 97' ' ' TRP . 23.0 m-80 -104.89 10.98 34.15 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.5 -1.227 . . . . 0.93 109.715 -174.465 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 106.56 -12.54 42.89 Favored Glycine 0 N--CA 1.439 -1.164 0 CA-C-N 114.618 -1.174 . . . . 0.56 113.116 174.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' GLY . . . . . 0.517 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 102.29 174.45 27.44 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.366 -0.921 . . . . 0.49 112.098 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.411 ' HB3' ' CB ' ' A' ' 46' ' ' VAL . 56.0 m95 -63.97 -42.95 97.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.712 0.291 . . . . 3.57 110.936 -178.239 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.487 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 26.9 t70 -53.8 -48.99 69.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.609 . . . . 1.96 110.882 177.34 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.556 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 67.9 m -58.9 -34.6 71.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.724 -0.671 . . . . 0.67 111.501 179.773 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -60.45 -45.27 94.29 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.698 -0.482 . . . . 3.0 109.698 -179.258 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.582 HG21 ' HB1' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -72.62 -26.78 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.186 -0.461 . . . . 1.15 110.314 178.0 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 18.5 mm-40 -60.98 -29.98 70.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.952 0.406 . . . . 1.67 110.244 173.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.9 mt -94.1 -60.25 1.78 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.146 -0.479 . . . . 1.3 110.959 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 155' ' ' TYR . . . . . 0.687 ' HB2' ' HH2' ' A' ' 97' ' ' TRP . 3.2 t80 -121.05 26.37 9.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.338 0.59 . . . . 4.24 110.468 -172.41 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.51 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -61.45 162.59 24.39 Favored Glycine 0 CA--C 1.499 -0.966 0 CA-C-N 115.716 -0.675 . . . . 1.1 112.83 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.579 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 5.4 t30 . . . . . 0 C--N 1.309 -1.193 0 CA-C-N 114.12 -1.04 . . . . 1.29 110.754 178.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1005 ' ' GLY . . . . . 0.904 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.541 1.679 0 N-CA-C 114.188 0.435 . . . . 1.2 114.188 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1006 ' ' ARG . . . . . 0.401 ' O ' ' HB3' ' B' 1009 ' ' ALA . 24.2 mmt180 -139.51 -41.58 0.45 Allowed 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 123.446 0.698 . . . . 2.88 109.754 177.184 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B 1007 ' ' ALA . . . . . 0.526 ' O ' ' HD1' ' B' 1011 ' ' PHE . . . -59.9 -61.06 2.89 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 116.19 -0.459 . . . . 1.31 111.307 -177.847 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.838 HD22 ' H ' ' B' 1008 ' ' LEU . 1.0 OUTLIER -63.45 -39.8 95.43 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.49 -0.93 . . . . 1.33 108.49 -179.19 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B 1009 ' ' ALA . . . . . 1.028 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -48.6 -49.97 34.6 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.521 -1.218 . . . . 0.88 110.58 172.213 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -78.18 -43.52 28.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.704 -1.135 . . . . 1.03 112.021 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1011 ' ' PHE . . . . . 0.526 ' HD1' ' O ' ' B' 1007 ' ' ALA . 46.3 m-85 -67.14 -26.73 66.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.223 0.535 . . . . 1.67 110.42 178.534 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B 1012 ' ' GLY . . . . . 0.463 ' HA2' ' HE1' ' A' ' 57' ' ' PHE . . . -79.93 -6.77 88.98 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.45 -0.796 . . . . 0.78 112.606 178.24 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 26.9 t70 -81.59 -2.95 51.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.483 0.658 . . . . 1.9 109.941 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 20.2 m . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 115.883 -0.599 . . . . 1.44 111.045 -178.88 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.639 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 76.4 mm-40 . . . . . 0 N--CA 1.462 0.139 0 N-CA-C 113.418 0.895 . . . . 2.42 113.418 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.0 p -68.68 -18.31 64.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.109 0.48 . . . . 1.25 110.626 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.762 ' HB2' HD13 ' A' ' 134' ' ' LEU . 0.2 OUTLIER -68.88 -20.76 64.27 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.029 -0.532 . . . . 1.78 111.06 176.304 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.719 ' N ' HD21 ' A' ' 5' ' ' ASN . 0.1 OUTLIER -51.96 -51.77 54.88 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.801 -0.636 . . . . 1.4 110.31 175.95 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.555 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 40.2 mt-10 -59.39 -48.2 82.56 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.867 -1.06 . . . . 0.68 111.453 -176.642 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.668 HD22 ' HA ' ' A' ' 5' ' ' ASN . 1.4 mp -49.61 -34.55 18.28 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.439 -0.8 . . . . 1.16 111.087 176.799 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.564 HG21 ' N ' ' A' ' 131' ' ' ALA . 72.6 t -79.39 -63.1 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.498 0.666 . . . . 0.27 109.909 174.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 6' ' ' ARG . 93.6 t -50.66 -56.6 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.471 -1.241 . . . . 0.33 112.766 -174.715 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.08 -33.08 68.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.709 0.29 . . . . 0.59 110.469 -177.544 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 4.0 t80 -74.97 -46.2 37.03 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.287 -0.415 . . . . 1.61 110.735 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.95 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.9 mp -62.72 -40.79 98.3 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 120.103 -0.639 . . . . 0.34 110.202 178.238 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.8 t -61.17 -40.7 94.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.172 0.51 . . . . 1.05 110.065 176.101 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.431 ' HD2' ' HE3' ' A' ' 16' ' ' LYS . 81.3 t80 -63.15 -22.1 66.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.529 -0.759 . . . . 1.22 110.889 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.724 ' HE2' ' HA ' ' A' ' 16' ' ' LYS . 10.5 mmpt? -86.35 -43.75 12.62 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.516 0.674 . . . . 1.41 110.203 -179.057 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.658 HD21 ' SG ' ' A' ' 111' ' ' CYS . 14.5 mt -66.69 -30.86 71.2 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 115.018 -0.992 . . . . 1.35 110.69 178.162 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.0 t -56.31 -43.51 79.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.541 -0.754 . . . . 0.94 111.564 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.406 ' HG3' ' O ' ' A' ' 16' ' ' LYS . 6.8 pt20 -80.22 0.97 30.22 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.073 0.463 . . . . 1.37 112.103 -177.413 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.657 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 19.9 mmmt -108.28 -26.5 10.51 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 122.113 0.959 . . . . 2.2 108.788 177.42 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 22.28 10.37 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 113.642 -1.617 . . . . 0.53 111.47 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.713 ' HB3' ' HE2' ' A' ' 27' ' ' PHE . 89.9 m-85 -113.13 156.39 23.27 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.855 0.36 . . . . 0.76 110.879 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.7 t -93.13 147.75 22.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.811 -0.631 . . . . 0.52 110.688 -179.28 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -73.33 -53.01 11.84 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.794 -0.639 . . . . 3.36 110.022 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -68.4 -28.89 67.49 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.186 0.439 . . . . 1.37 112.186 -173.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -61.22 -29.63 69.94 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.672 -0.411 . . . . 1.11 111.363 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.713 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 13.5 m-85 -109.96 -15.34 14.09 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.3 -0.409 . . . . 1.28 111.338 -175.53 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.677 ' HB3' HG22 ' A' ' 30' ' ' VAL . 34.6 m -101.36 148.34 25.27 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 122.254 1.026 . . . . 1.81 112.632 -176.729 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.29 -2.84 11.07 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 113.113 -1.858 . . . . 2.31 109.149 -177.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.911 HG23 ' H ' ' A' ' 31' ' ' GLU . 5.2 m -64.66 -75.76 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 114.636 -1.166 . . . . 0.92 113.141 -169.132 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.911 ' H ' HG23 ' A' ' 30' ' ' VAL . 10.2 mm-40 -85.24 -2.28 57.87 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 122.075 0.94 . . . . 2.74 108.861 -179.191 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 . . . . . 0 N--CA 1.441 -0.916 0 CA-C-N 114.188 -1.369 . . . . 1.45 110.425 174.91 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.812 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.2 t . . . . . 0 CA--C 1.539 0.52 0 CA-C-O 120.693 0.282 . . . . 1.12 110.408 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.812 ' H ' HG23 ' A' ' 41' ' ' THR . 17.0 pt-20 -94.7 -23.51 17.54 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 122.999 1.38 . . . . 2.02 108.291 165.758 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.843 ' HB2' ' HE3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -63.04 -30.0 71.25 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 111.955 -2.384 . . . . 1.25 114.562 -169.725 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -46.19 -50.31 15.88 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 118.202 0.455 . . . . 1.91 111.614 -173.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.604 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -74.93 -37.75 61.96 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.982 0.42 . . . . 0.52 110.368 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.626 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 72.2 t -54.93 -65.21 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.37 -0.832 . . . . 1.41 111.306 177.132 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.843 ' HE3' ' HB2' ' A' ' 43' ' ' SER . 19.3 ptpt -60.85 -34.51 74.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.865 -0.607 . . . . 0.67 110.176 -176.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.458 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 38.3 mm-40 -62.34 -36.36 81.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.64 -0.709 . . . . 0.99 111.446 174.264 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.774 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -76.85 -35.25 57.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.497 0.665 . . . . 0.42 110.066 175.261 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.577 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -54.85 -39.29 68.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.742 -1.117 . . . . 1.33 112.118 -179.771 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.405 ' HG2' ' H ' ' A' ' 51' ' ' ARG . 13.0 ptp180 -79.59 -33.53 41.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.588 0.709 . . . . 2.17 109.426 -174.381 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.677 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.0 mm-40 -67.95 -43.67 78.52 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.582 -1.19 . . . . 1.1 110.218 178.082 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.57 -41.49 72.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.495 -0.775 . . . . 0.53 110.723 177.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.697 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.41 -44.62 97.36 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.825 -0.625 . . . . 0.7 112.52 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.57 ' O ' HD22 ' A' ' 59' ' ' LEU . 28.8 t70 -54.33 -32.01 55.64 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.074 0.464 . . . . 1.04 111.294 -178.279 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -80.22 -25.6 39.54 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.379 -0.828 . . . . 2.29 112.488 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.633 ' CZ ' HD12 ' B' 1008 ' ' LEU . 91.7 t80 -82.54 -43.05 17.59 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.566 0.58 . . . . 2.29 112.566 -179.412 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.697 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 30.4 mt-10 -58.33 -48.03 81.85 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.494 0.924 . . . . 1.3 113.494 -168.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.62 ' H ' ' CD2' ' A' ' 59' ' ' LEU . 1.0 OUTLIER -78.74 -7.81 58.13 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 123.717 0.807 . . . . 1.54 112.409 -172.119 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 67.8 mtt-85 -45.01 -27.39 0.54 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 116.221 1.934 . . . . 2.58 116.221 -161.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -90.38 -85.94 0.21 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 117.16 -1.816 . . . . 5.32 109.894 174.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 56.6 mtm180 -109.18 -82.06 0.57 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 119.534 1.061 . . . . 4.48 111.636 158.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.673 ' HB2' ' OD1' ' A' ' 67' ' ' ASP . 0.0 OUTLIER -103.07 11.65 36.93 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 113.844 -1.525 . . . . 4.72 110.966 171.182 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.739 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -27.89 -54.99 0.1 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.378 1.622 . . . . 1.17 115.378 -150.371 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.453 ' CG ' ' HB3' ' A' ' 58' ' ' GLU . 19.6 p90 -47.82 -28.57 2.64 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 113.088 0.773 . . . . 2.81 113.088 -176.561 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.7 m -90.69 -36.66 14.22 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.202 0.445 . . . . 2.19 112.202 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.673 ' OD1' ' HB2' ' A' ' 63' ' ' ARG . 4.5 m-20 -83.01 -23.21 33.37 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.799 0.296 . . . . 2.72 111.799 -174.635 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.739 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 32.2 mt -61.47 -15.55 38.61 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.717 1.006 . . . . 1.56 113.717 -171.675 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.72 HG22 HG13 ' A' ' 74' ' ' ILE . 34.4 p -47.81 -29.27 3.06 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 123.314 0.384 . . . . 0.7 111.482 -177.766 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.8 t -53.28 -59.38 4.64 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.752 -0.658 . . . . 1.34 111.143 175.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.494 ' OE1' ' HA ' ' A' ' 68' ' ' LEU . 3.1 mp0 -54.51 -48.09 72.31 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.682 0.793 . . . . 1.42 111.814 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.75 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.1 mp -81.25 -28.27 34.84 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.104 -0.953 . . . . 1.37 111.922 -168.081 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.5 t-80 62.8 64.38 0.89 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 122.155 0.978 . . . . 2.72 108.711 -177.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.72 HG13 HG22 ' A' ' 69' ' ' THR . 15.5 mm -65.03 118.54 7.54 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 113.963 -1.472 . . . . 0.91 111.627 -174.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.729 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.26 -172.18 0.3 Allowed Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 107.47 -1.307 . . . . 0.51 107.47 -171.247 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.729 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.3 Cg_exo -30.33 167.27 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 125.035 3.823 . . . . 0.47 115.112 164.005 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.41 -25.68 0.0 OUTLIER Glycine 0 N--CA 1.475 1.239 0 N-CA-C 117.606 1.803 . . . . 0.4 117.606 -174.375 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.473 ' N ' ' O ' ' A' ' 76' ' ' PRO . 34.6 p -72.05 6.76 1.95 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 118.119 0.959 . . . . 0.56 111.514 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.46 -16.71 61.81 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 109.304 -0.628 . . . . 0.34 109.304 169.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.543 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 66.2 t80 -76.06 -15.12 60.17 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.574 -0.739 . . . . 4.13 109.186 174.325 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.501 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 78.1 mt-30 -82.85 -28.79 29.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.766 0.793 . . . . 1.03 109.487 172.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.75 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.5 m -72.05 -53.14 13.8 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.58 -1.191 . . . . 0.48 109.687 173.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.511 ' HE1' ' HB3' ' A' ' 106' ' ' PHE . 78.8 t80 -65.13 -18.94 65.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.559 -0.746 . . . . 1.18 110.345 175.72 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.64 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.6 tt0 -60.59 -46.91 88.48 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 115.724 -0.671 . . . . 0.8 110.426 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -49.1 -34.6 14.25 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.749 -1.114 . . . . 1.62 110.796 177.214 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.808 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.4 t -82.68 -54.72 8.84 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.025 -0.988 . . . . 1.3 110.867 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.64 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.8 p -60.46 -25.31 33.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.537 0.684 . . . . 0.85 109.648 -177.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -62.08 -56.5 18.27 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.789 -1.096 . . . . 0.91 110.742 171.607 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.917 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.0 OUTLIER -62.05 -36.36 81.4 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 108.428 -0.953 . . . . 2.87 108.428 -175.738 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.782 HD23 ' HE ' ' A' ' 99' ' ' ARG . 27.3 mt -70.9 -24.28 62.44 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 113.672 -1.603 . . . . 1.28 112.345 -170.159 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.742 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 1.7 p90 -106.81 -23.56 12.35 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.052 0.453 . . . . 2.3 111.516 -176.31 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.531 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 5.8 ptm180 -88.18 -41.56 12.9 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.889 0.376 . . . . 5.06 111.71 -172.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -100.83 18.11 20.34 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.824 0.676 . . . . 3.12 112.824 -165.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.528 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 129.03 69.38 0.12 Allowed Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 117.574 -2.25 . . . . 2.31 114.846 178.137 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.742 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 61.1 t -70.7 103.94 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 118.421 1.111 . . . . 1.06 110.416 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -110.93 -175.06 2.62 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.973 -1.012 . . . . 2.12 108.427 176.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.535 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 21.8 m-90 -54.72 -47.33 73.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.008 0.432 . . . . 3.34 110.27 178.283 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.13 -30.47 71.9 Favored Glycine 0 CA--C 1.519 0.317 0 CA-C-N 115.738 -0.664 . . . . 0.69 113.772 -176.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.782 ' HE ' HD23 ' A' ' 90' ' ' LEU . 9.9 mmm-85 -62.68 -35.61 80.23 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.4 0.619 . . . . 4.24 110.798 -178.006 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.508 ' O ' ' HB3' ' A' ' 103' ' ' PHE . 72.5 mt -75.01 -41.25 45.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 CA-C-N 115.53 -0.759 . . . . 0.44 110.812 -177.466 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -59.53 -35.93 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 109.671 -0.492 . . . . 1.35 109.671 174.604 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.16 87.27 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.786 -0.643 . . . . 0.44 110.632 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.535 ' HZ ' ' HA ' ' A' ' 130' ' ' MET . 67.4 t80 -51.9 -42.87 63.06 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.13 -0.941 . . . . 1.49 110.12 173.529 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.841 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 89.0 m-85 -75.41 -39.7 58.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.076 -0.511 . . . . 3.29 111.367 178.006 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.49 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 19.3 m -56.16 -50.13 72.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.063 0.459 . . . . 1.19 110.365 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.511 ' HB3' ' HE1' ' A' ' 83' ' ' PHE . 1.2 t80 -79.07 -35.42 42.47 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.95 -0.568 . . . . 2.89 110.569 -178.226 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.673 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.06 -43.46 95.7 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.75 -0.738 . . . . 0.3 111.999 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.95 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.64 -33.02 79.7 Favored Glycine 0 N--CA 1.443 -0.89 0 N-CA-C 110.875 -0.89 . . . . 0.23 110.875 175.666 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.77 -34.25 73.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.47 -0.365 . . . . 0.31 110.606 176.371 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.538 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.47 -39.57 94.81 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 108.257 -1.016 . . . . 1.12 108.257 -178.806 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.679 ' SG ' HG22 ' A' ' 123' ' ' VAL . 43.9 t -52.78 -52.6 56.04 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 113.899 -1.5 . . . . 0.26 109.913 173.167 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.568 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 92.6 t -68.07 -38.43 79.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.97 -0.559 . . . . 0.35 111.686 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.5 ' HB3' HG21 ' A' ' 74' ' ' ILE . 35.7 mt-10 -58.11 -28.17 64.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.158 0.504 . . . . 2.51 110.027 176.521 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.46 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 50.8 m -79.01 -41.28 29.29 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.859 -0.61 . . . . 0.28 109.503 176.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 111' ' ' CYS . 88.0 t -64.04 -33.92 65.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 122.066 0.936 . . . . 1.23 109.455 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ASP . . . . . 0.454 ' OD1' ' HD3' ' A' ' 117' ' ' LYS . 15.2 t70 -51.54 -50.39 60.14 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 113.401 -1.727 . . . . 0.6 111.278 178.186 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.454 ' HD3' ' OD1' ' A' ' 116' ' ' ASP . 12.1 mmtp -88.33 13.3 11.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.061 -0.518 . . . . 1.62 110.231 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.446 ' HA ' HE21 ' A' ' 120' ' ' GLN . 44.4 mt-10 63.2 42.84 6.76 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-O 121.657 0.742 . . . . 1.88 110.749 -177.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.46 ' CE ' ' HA ' ' A' ' 114' ' ' SER . 29.7 mtm -116.16 46.29 1.6 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.069 -1.086 . . . . 0.31 108.069 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.446 HE21 ' HA ' ' A' ' 118' ' ' GLU . 3.7 mt-30 -61.61 -7.45 3.35 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.468 -1.242 . . . . 1.15 112.847 -175.84 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.562 HG23 HD22 ' A' ' 122' ' ' LEU . 27.8 m -65.82 -27.31 40.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 122.244 -0.285 . . . . 0.46 111.067 173.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.693 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -70.8 -29.45 65.64 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 116.569 -0.287 . . . . 0.26 110.321 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.679 HG22 ' SG ' ' A' ' 111' ' ' CYS . 76.3 t -43.05 -55.5 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 O-C-N 124.001 0.813 . . . . 0.25 111.909 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.579 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 2.9 t -70.32 -35.0 73.36 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.779 0.323 . . . . 1.35 110.914 -178.103 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.693 ' HD2' HD13 ' A' ' 122' ' ' LEU . 94.7 mtt180 -63.47 -56.02 19.46 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 121.13 0.491 . . . . 2.67 110.158 -178.243 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.538 HD13 ' HB3' ' A' ' 110' ' ' LEU . 68.8 mt -51.82 -53.72 16.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.139 -0.937 . . . . 0.23 110.964 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.532 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -54.84 -34.45 62.87 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 111.711 0.263 . . . . 0.29 111.711 -178.508 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.13 -58.05 8.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.48 0.657 . . . . 0.28 110.892 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -68.76 -26.1 65.05 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.026 -0.988 . . . . 3.91 111.224 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.673 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 21.5 mmm -62.87 -60.57 3.29 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.168 -0.469 . . . . 1.08 110.683 176.755 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.564 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -62.37 -35.11 78.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.173 -0.467 . . . . 0.25 110.972 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 89.6 m -63.71 -47.47 80.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.336 -0.393 . . . . 0.4 111.261 176.689 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.408 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 3.4 t80 -60.35 -37.35 80.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.96 -0.385 . . . . 3.13 109.96 179.708 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.841 HD12 ' HZ ' ' A' ' 104' ' ' PHE . 5.9 tt -64.1 -50.2 69.21 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.752 -0.832 . . . . 0.95 108.752 173.283 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -47.95 -57.37 5.82 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.878 -0.601 . . . . 0.46 112.028 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -80.85 -48.85 11.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.398 0.518 . . . . 0.59 112.398 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' HIS . . . . . 0.408 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 0.3 OUTLIER -90.77 -47.81 7.41 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.127 0.788 . . . . 1.45 113.127 -169.007 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 58.2 mt -91.04 -32.89 15.73 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.011 0.745 . . . . 1.2 113.011 -165.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.629 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 29.6 tt0 -49.67 -50.23 68.07 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 111.915 0.339 . . . . 0.75 111.915 -174.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.613 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 13.3 Cg_endo -57.83 -49.7 12.36 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.902 1.735 . . . . 0.56 111.913 175.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 141' ' ' TRP . . . . . 0.42 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -56.02 -47.41 77.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.721 -0.672 . . . . 1.2 110.471 179.282 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.545 HD12 ' HA ' ' A' ' 139' ' ' GLU . 15.0 mt -50.15 -50.86 19.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.609 -0.723 . . . . 0.32 111.27 175.2 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.629 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 80.8 mm-40 -58.84 -34.09 71.18 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.572 -0.74 . . . . 0.57 111.252 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.613 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 6.1 mm-40 -66.57 -21.71 66.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.381 0.61 . . . . 0.78 110.773 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -102.42 -4.95 24.68 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.504 -0.771 . . . . 0.93 109.787 -174.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 123.13 -31.92 4.54 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.479 -0.782 . . . . 0.56 112.851 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' GLY . . . . . 0.501 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 123.45 -175.48 16.71 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.731 -0.747 . . . . 0.49 112.046 -178.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.475 ' NE1' HD13 ' A' ' 142' ' ' ILE . 11.2 m-90 -78.68 -39.69 36.01 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.839 0.352 . . . . 3.57 110.38 -178.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -61.98 -42.21 98.88 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.109 -0.496 . . . . 1.96 110.07 179.109 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.607 ' O ' HD13 ' A' ' 154' ' ' LEU . 85.0 m -57.4 -35.5 70.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.768 -0.651 . . . . 0.67 110.869 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.535 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 78.7 t80 -60.66 -39.84 89.85 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 120.43 -0.508 . . . . 3.0 110.102 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.604 HG21 ' HB1' ' A' ' 45' ' ' ALA . 1.3 m -78.18 -26.19 14.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.158 0.504 . . . . 1.15 110.331 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -59.33 -42.32 91.19 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.399 0.619 . . . . 1.67 109.695 171.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.607 HD13 ' O ' ' A' ' 150' ' ' THR . 8.1 mp -80.37 -60.04 2.47 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.093 -0.958 . . . . 1.3 112.873 177.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -119.86 27.04 8.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.272 0.558 . . . . 4.24 110.203 -168.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.774 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -57.17 161.69 8.22 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-O 122.022 0.79 . . . . 1.1 114.665 -178.788 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.677 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 7.8 t30 . . . . . 0 C--N 1.316 -0.865 0 CA-C-N 113.202 -1.499 . . . . 1.29 111.601 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.013 0 CA-C-O 120.926 0.181 . . . . 1.2 113.014 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B 1006 ' ' ARG . . . . . 0.427 HH11 ' HD2' ' B' 1006 ' ' ARG . 3.7 mpt_? -90.59 -41.74 11.18 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.776 0.322 . . . . 2.88 111.241 175.608 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -70.32 -66.13 0.64 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.466 0.543 . . . . 1.31 112.466 -171.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.633 HD12 ' CZ ' ' A' ' 57' ' ' PHE . 3.3 mm? -57.5 -40.04 77.83 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.312 0.577 . . . . 1.33 110.18 -173.846 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B 1009 ' ' ALA . . . . . 0.917 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -53.92 -40.19 66.48 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.642 -1.163 . . . . 0.88 110.726 176.415 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -80.25 -41.22 25.48 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.827 -1.078 . . . . 1.03 111.143 -177.493 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -70.52 -33.63 71.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.702 -0.681 . . . . 1.67 111.581 -178.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -70.84 -24.42 77.05 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.188 -0.53 . . . . 0.78 113.367 -175.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 38.5 t70 -74.19 -4.24 34.72 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.206 0.527 . . . . 1.9 111.061 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 22.4 m . . . . . 0 C--N 1.328 -0.341 0 CA-C-O 121.011 0.434 . . . . 1.44 110.202 179.842 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.646 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 26.8 mp0 . . . . . 0 C--O 1.224 -0.266 0 CA-C-O 120.623 0.249 . . . . 2.42 110.985 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.604 ' O ' HD13 ' A' ' 8' ' ' LEU . 19.3 m -72.45 -23.66 61.09 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 111.683 0.253 . . . . 1.25 111.683 -174.326 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.943 ' HA ' HD22 ' A' ' 8' ' ' LEU . 6.3 p30 -65.16 -22.43 66.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.763 0.316 . . . . 1.78 110.434 175.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.646 ' HB2' ' O ' ' A' ' 3' ' ' GLN . 0.6 OUTLIER -58.55 -53.15 61.59 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 115.949 -0.569 . . . . 1.4 110.133 173.89 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -56.23 -49.11 75.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.184 -0.916 . . . . 0.68 110.733 -178.145 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.943 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.6 OUTLIER -47.49 -44.19 25.2 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.499 -0.773 . . . . 1.16 111.056 176.385 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.529 HG13 ' HE2' ' A' ' 130' ' ' MET . 72.9 t -70.79 -64.05 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.296 0.57 . . . . 0.27 110.548 175.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.593 HG23 ' O ' ' A' ' 6' ' ' ARG . 48.8 t -51.83 -48.49 38.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 114.906 -1.043 . . . . 0.33 112.676 -174.325 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -56.03 -38.06 70.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.291 -0.413 . . . . 0.59 110.679 -178.004 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.646 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 47.6 t80 -74.33 -45.01 50.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.136 -0.483 . . . . 1.61 110.964 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.726 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.8 mp -57.67 -44.06 85.49 Favored 'General case' 0 C--N 1.338 0.083 0 C-N-CA 120.386 -0.525 . . . . 0.34 109.846 178.514 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 m -58.48 -40.47 82.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.47 0.652 . . . . 1.05 110.675 177.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -73.67 -17.99 61.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.299 -0.864 . . . . 1.22 111.215 -174.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.668 ' HE2' ' HA ' ' A' ' 16' ' ' LYS . 10.0 mmpt? -88.52 -47.75 8.09 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-O 121.5 0.667 . . . . 1.41 110.32 -178.436 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.6 HD21 ' SG ' ' A' ' 111' ' ' CYS . 13.4 mt -57.41 -30.8 65.25 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 115.258 -0.883 . . . . 1.35 111.335 177.492 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.5 t -57.24 -47.78 80.49 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.112 -0.495 . . . . 0.94 111.409 177.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -74.14 1.4 11.29 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.931 0.396 . . . . 1.37 111.854 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.627 ' HE2' HG11 ' A' ' 112' ' ' VAL . 15.3 mmmt -110.49 -26.74 9.34 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.953 0.883 . . . . 2.2 109.172 178.328 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.72 26.3 7.23 Favored Glycine 0 N--CA 1.443 -0.833 0 CA-C-N 114.014 -1.448 . . . . 0.53 111.921 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -122.59 167.19 13.7 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.851 0.358 . . . . 0.76 110.831 174.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.9 t -110.55 151.19 27.9 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.897 -0.592 . . . . 0.52 110.003 177.205 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -72.67 -51.1 20.85 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.08 -0.509 . . . . 3.36 109.759 172.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.1 p -61.72 -40.61 95.69 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.68 -0.691 . . . . 1.37 111.596 -171.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -55.74 -31.0 62.15 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.103 0.478 . . . . 1.11 111.33 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.409 ' O ' ' HB2' ' A' ' 124' ' ' SER . 67.1 m-85 -114.14 16.05 18.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.937 -0.574 . . . . 1.28 111.125 -176.19 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.619 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 59.8 p -100.97 -179.68 4.12 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.739 0.781 . . . . 1.81 112.359 -175.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.58 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 6.9 t70 -163.91 -24.44 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 113.934 -1.485 . . . . 2.31 108.142 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.926 HG23 ' H ' ' A' ' 31' ' ' GLU . 9.9 m -57.91 -72.88 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 113.884 -1.507 . . . . 0.92 112.874 -177.232 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.926 ' H ' HG23 ' A' ' 30' ' ' VAL . 14.5 mm-40 -86.59 -0.05 55.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.543 -0.91 . . . . 2.74 108.543 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.58 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.1 tt0 . . . . . 0 N--CA 1.445 -0.724 0 CA-C-N 114.663 -1.153 . . . . 1.45 110.182 178.575 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.821 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.5 t . . . . . 0 CA--C 1.539 0.545 0 CA-C-O 120.496 0.189 . . . . 1.12 110.586 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.821 ' H ' HG23 ' A' ' 41' ' ' THR . 12.8 pt-20 -93.1 -29.99 15.49 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 122.545 1.164 . . . . 2.02 108.692 168.438 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.702 ' HA ' HG13 ' A' ' 46' ' ' VAL . 3.7 p -60.06 -27.13 66.71 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 112.717 -2.038 . . . . 1.25 113.599 -170.65 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -46.17 -54.15 9.2 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 111.8 0.296 . . . . 1.91 111.8 -176.605 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.99 -41.76 61.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.555 0.217 . . . . 0.52 111.521 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.702 HG13 ' HA ' ' A' ' 43' ' ' SER . 0.5 OUTLIER -70.19 -37.15 70.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.896 -0.322 . . . . 1.41 111.29 -174.787 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.568 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 8.4 ptpt -68.12 -36.38 79.63 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.4 -0.963 . . . . 0.67 108.4 176.924 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.498 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 16.0 mm-40 -63.79 -38.84 92.61 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.195 -0.911 . . . . 0.99 110.619 178.399 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.689 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -74.0 -41.38 61.97 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.183 0.516 . . . . 0.42 110.632 176.586 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.45 HD22 ' HA ' ' A' ' 50' ' ' LEU . 0.1 OUTLIER -54.6 -43.53 72.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.092 -0.958 . . . . 1.33 111.687 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.568 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 7.9 ptp180 -74.58 -26.16 59.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.179 0.514 . . . . 2.17 110.026 -170.214 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.498 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 5.3 mm-40 -74.17 -51.46 15.44 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.898 -1.046 . . . . 1.1 110.077 178.056 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.32 -42.13 99.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.517 -0.765 . . . . 0.53 110.19 177.075 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.613 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -64.74 -38.29 95.43 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.584 -0.735 . . . . 0.7 111.95 176.729 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.431 ' HA ' ' OE2' ' A' ' 58' ' ' GLU . 14.7 t70 -57.59 -54.14 50.2 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 122.337 0.255 . . . . 1.04 110.496 177.039 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.538 ' HA ' HD11 ' A' ' 59' ' ' LEU . 48.0 mt-10 -56.99 -27.72 61.72 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 123.847 0.717 . . . . 2.29 111.569 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -72.98 -30.67 63.98 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.929 -0.578 . . . . 2.29 110.921 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 41.0 mt-10 -70.47 -70.27 0.31 Allowed 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 112.18 0.437 . . . . 1.3 112.18 -173.652 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.674 HD22 ' N ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -55.6 -34.52 64.93 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.083 0.468 . . . . 1.54 111.457 -174.661 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.674 ' N ' HD22 ' A' ' 59' ' ' LEU . 7.3 ttm180 -53.04 -66.39 0.39 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.337 -0.847 . . . . 2.58 111.676 176.865 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -94.22 -0.23 55.27 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.161 0.8 . . . . 5.32 113.161 -172.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.479 ' HA ' ' CD2' ' A' ' 65' ' ' PHE . 3.0 tmt_? -43.69 -38.41 3.11 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.38 0.672 . . . . 4.48 112.272 -176.272 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 67.1 mtt180 -46.39 -50.36 16.68 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.111 0.481 . . . . 4.72 110.551 176.374 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.453 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -71.91 -47.76 50.34 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 115.609 -0.723 . . . . 1.17 110.854 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.479 ' CD2' ' HA ' ' A' ' 62' ' ' ARG . 17.9 m-85 -45.9 -48.65 16.12 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.905 0.706 . . . . 2.81 112.905 -172.719 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' SER . . . . . 0.412 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 27.8 t -62.46 -38.28 89.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.111 0.481 . . . . 2.19 110.894 -177.262 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -81.21 -31.58 33.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.183 0.516 . . . . 2.72 110.479 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 64' ' ' ALA . 1.8 mp -60.64 -17.66 48.65 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.309 -0.859 . . . . 1.56 112.296 -177.225 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.73 HG22 HG13 ' A' ' 74' ' ' ILE . 3.4 p -55.83 -25.43 41.79 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.165 0.439 . . . . 0.7 110.926 177.493 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.5 t -74.35 -37.24 63.56 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.266 0.555 . . . . 1.34 109.535 175.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -72.36 -40.89 67.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.321 -0.854 . . . . 1.42 110.37 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.432 ' O ' ' HB3' ' A' ' 73' ' ' HIS . 3.1 mm? -68.25 -34.31 75.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.641 -0.503 . . . . 1.37 109.641 170.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.432 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 85.9 t60 71.11 0.76 3.54 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.586 -0.734 . . . . 2.72 109.844 -171.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.73 HG13 HG22 ' A' ' 69' ' ' THR . 31.6 mm 20.12 -85.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 126.0 1.72 . . . . 0.91 114.256 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.891 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER 23.14 -160.87 0.0 OUTLIER Pre-proline 0 CA--C 1.588 2.423 0 C-N-CA 125.033 1.333 . . . . 0.51 113.513 -173.927 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.891 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 76.2 Cg_exo -28.13 165.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 125.267 3.978 . . . . 0.47 117.281 169.266 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -34.68 -20.9 0.01 OUTLIER Glycine 0 C--N 1.347 1.153 0 N-CA-C 117.627 1.811 . . . . 0.4 117.627 -173.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.438 ' N ' ' O ' ' A' ' 76' ' ' PRO . 38.2 p -66.69 0.91 2.04 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 117.97 0.885 . . . . 0.56 111.481 178.559 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.512 ' HB2' ' O ' ' A' ' 74' ' ' ILE . . . -67.91 -14.72 63.19 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.987 -0.552 . . . . 0.34 110.272 172.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -78.31 -21.01 50.29 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.367 -0.605 . . . . 4.13 109.367 176.445 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.544 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 41.9 mt-30 -81.86 -25.87 34.71 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.006 0.908 . . . . 1.03 109.387 172.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.488 ' OG ' ' HA ' ' A' ' 79' ' ' ALA . 2.3 m -72.23 -54.22 10.26 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.344 -1.298 . . . . 0.48 109.743 173.681 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.48 ' HE2' ' CE1' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -62.41 -19.5 63.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.887 -1.051 . . . . 1.18 110.213 176.21 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.602 ' HA ' HG12 ' A' ' 87' ' ' VAL . 37.2 tt0 -63.39 -51.6 65.17 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.043 -0.981 . . . . 0.8 111.027 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -50.03 -33.05 16.94 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.076 -0.965 . . . . 1.62 110.82 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.686 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -83.13 -51.65 14.19 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.04 0 CA-C-N 114.605 -1.179 . . . . 1.3 110.725 -177.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.602 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.8 p -61.64 -22.38 28.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.888 0.851 . . . . 0.85 109.378 -178.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.577 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.7 m-80 -68.07 -51.72 43.35 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 114.142 -1.39 . . . . 0.91 110.912 173.499 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.976 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.9 OUTLIER -65.45 -37.31 86.5 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 121.763 0.792 . . . . 2.87 108.872 -178.932 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.624 ' HG ' ' CD ' ' A' ' 89' ' ' GLU . 21.1 mt -67.17 -19.22 65.55 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 113.907 -1.497 . . . . 1.28 112.591 -167.332 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.735 ' HA ' HG22 ' A' ' 95' ' ' VAL . 2.7 p90 -109.94 -19.7 13.01 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.78 -0.368 . . . . 2.3 111.878 -174.659 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.577 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.0 OUTLIER -100.98 -22.53 14.74 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.255 -0.578 . . . . 5.06 111.253 -177.984 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -96.15 21.19 9.18 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.822 -0.626 . . . . 3.12 111.345 -169.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 112.82 67.62 0.51 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 118.291 -1.909 . . . . 2.31 114.059 175.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.735 HG22 ' HA ' ' A' ' 91' ' ' PHE . 38.8 t -70.33 95.63 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.465 0 CA-C-O 122.67 1.224 . . . . 1.06 110.928 -177.393 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.506 ' OD1' ' HG2' ' A' ' 99' ' ' ARG . 2.5 p30 -110.2 179.21 4.16 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 113.095 -1.866 . . . . 2.12 107.252 167.618 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.606 ' HB3' ' CD2' ' A' ' 151' ' ' PHE . 12.7 m-90 -51.87 -44.06 63.55 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 123.411 0.444 . . . . 3.34 111.529 -176.278 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -62.71 -33.14 85.89 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 114.662 0.625 . . . . 0.69 114.662 -176.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.506 ' HG2' ' OD1' ' A' ' 96' ' ' ASN . 81.5 mmt-85 -60.93 -38.72 86.79 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 117.632 0.716 . . . . 4.24 110.38 -178.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.595 HG12 ' HG ' ' A' ' 138' ' ' LEU . 81.4 mt -75.17 -35.4 34.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 115.196 -0.911 . . . . 0.44 111.281 -173.166 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.4 m -65.88 -33.78 65.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.549 -0.537 . . . . 1.35 109.549 173.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.51 -48.04 71.05 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.218 0.532 . . . . 0.44 109.603 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.48 ' CE1' ' HE2' ' A' ' 83' ' ' PHE . 42.8 t80 -50.48 -53.2 31.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.47 -1.241 . . . . 1.49 111.931 178.436 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.527 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 0.2 OUTLIER -80.08 -20.23 45.63 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.395 -0.522 . . . . 3.29 111.081 -175.027 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.646 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 31.3 t -75.01 -53.02 9.65 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.63 0.252 . . . . 1.19 110.382 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.521 ' CZ ' ' HB ' ' A' ' 86' ' ' VAL . 2.3 p90 -68.23 -22.08 64.8 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 109.599 -0.519 . . . . 2.89 109.599 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.464 ' HA2' ' HB2' ' A' ' 110' ' ' LEU . . . -75.07 -40.87 33.67 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.687 -0.768 . . . . 0.3 111.507 174.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.726 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -64.57 -33.98 88.69 Favored Glycine 0 N--CA 1.448 -0.5 0 N-CA-C 110.916 -0.874 . . . . 0.23 110.916 174.246 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.95 -29.23 58.22 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.532 -0.334 . . . . 0.31 110.449 173.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.464 ' HB2' ' HA2' ' A' ' 107' ' ' GLY . 0.2 OUTLIER -62.73 -39.67 94.79 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 107.758 -1.201 . . . . 1.12 107.758 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.727 ' SG ' HG22 ' A' ' 123' ' ' VAL . 41.1 t -48.69 -60.32 2.82 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 113.362 -1.744 . . . . 0.26 109.554 171.86 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.924 ' HA ' HG13 ' A' ' 115' ' ' VAL . 46.0 t -66.38 -31.65 54.54 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 CA-C-N 116.366 -0.379 . . . . 0.35 111.859 -178.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.533 ' O ' HG21 ' A' ' 74' ' ' ILE . 22.5 mt-10 -57.52 -20.72 33.42 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 118.28 0.491 . . . . 2.51 110.321 176.292 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.519 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 50.1 m -89.54 -44.93 9.76 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 108.465 -0.939 . . . . 0.28 108.465 179.578 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.924 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.4 m -67.86 -29.07 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.106 0 CA-C-N 115.061 -0.972 . . . . 1.23 109.623 -177.069 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -51.56 -50.62 59.73 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 113.379 -1.737 . . . . 0.6 111.169 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt -86.15 13.57 7.65 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.695 -0.684 . . . . 1.62 109.811 178.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.423 ' HA ' ' OE1' ' A' ' 120' ' ' GLN . 23.9 mm-40 63.57 53.54 2.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 122.016 0.912 . . . . 1.88 110.571 -177.629 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.554 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 27.1 mtm -132.27 39.83 3.37 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.197 -1.365 . . . . 0.31 107.457 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.661 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 0.0 OUTLIER -53.54 -6.82 0.08 Allowed 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 114.685 -1.143 . . . . 1.15 113.18 -178.542 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.563 HG23 HD22 ' A' ' 122' ' ' LEU . 21.1 m -67.71 -29.01 43.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.588 -0.695 . . . . 0.46 111.973 175.608 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.563 HD22 HG23 ' A' ' 121' ' ' VAL . 3.8 mm? -65.06 -27.27 68.67 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.02 0.438 . . . . 0.26 110.294 178.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.727 HG22 ' SG ' ' A' ' 111' ' ' CYS . 39.8 t -44.13 -46.4 2.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 114.384 -1.28 . . . . 0.25 112.165 -177.109 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.619 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 23.0 t -73.83 -43.28 59.22 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.325 -0.398 . . . . 1.35 111.743 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.452 ' HD3' HD12 ' A' ' 122' ' ' LEU . 8.6 ptm180 -72.24 -36.87 69.19 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.966 -0.293 . . . . 2.67 110.264 -170.233 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.577 HD12 ' HA ' ' A' ' 111' ' ' CYS . 82.4 mt -55.45 -49.58 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.642 -0.254 . . . . 0.23 111.323 174.759 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.563 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.2 -30.5 66.51 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.767 0.318 . . . . 0.29 111.478 -178.447 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.09 -60.66 3.28 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.395 0.617 . . . . 0.28 110.193 175.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.416 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 98.5 m95 -57.75 -41.8 82.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.648 -1.16 . . . . 3.91 111.045 -178.071 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.529 ' HE2' HG13 ' A' ' 9' ' ' VAL . 87.5 mtp -59.11 -57.74 11.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.457 -0.338 . . . . 1.08 111.416 -178.247 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.1 74.87 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.872 -0.331 . . . . 0.25 110.87 -177.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.421 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 22.4 m -68.02 -45.18 74.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.852 0.358 . . . . 0.4 111.458 176.744 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.61 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 13.0 m-85 -63.78 -33.29 75.33 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.896 -0.321 . . . . 3.13 110.422 177.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.819 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.7 tt -64.43 -50.95 65.58 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 108.354 -0.98 . . . . 0.95 108.354 170.079 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ASN . . . . . 0.421 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 2.3 m-80 -49.02 -60.83 2.44 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.651 0.611 . . . . 0.46 112.651 -179.366 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -78.51 -44.91 23.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.931 0.396 . . . . 0.59 111.941 -172.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' HIS . . . . . 0.61 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 14.5 m80 -90.54 -51.41 5.41 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.857 0.688 . . . . 1.45 112.857 -170.857 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.819 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -85.37 -47.07 10.35 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 113.932 1.086 . . . . 1.2 113.932 -168.844 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.694 ' HA ' HD12 ' A' ' 142' ' ' ILE . 37.7 tt0 -45.48 -52.72 21.56 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 112.891 0.7 . . . . 0.75 112.891 -173.857 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.596 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 51.5 Cg_exo -53.44 -48.97 19.08 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.717 1.612 . . . . 0.56 111.522 177.023 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -61.26 -46.1 91.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.332 -0.849 . . . . 1.2 110.339 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.694 HD12 ' HA ' ' A' ' 139' ' ' GLU . 37.5 mt -48.46 -51.25 11.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.073 0.464 . . . . 0.32 111.117 175.264 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.595 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 74.7 mm-40 -59.14 -32.92 70.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.453 -0.794 . . . . 0.57 111.485 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 12.3 mm-40 -64.59 -21.13 66.62 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.585 0.707 . . . . 0.78 110.871 177.48 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -106.76 11.86 29.75 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.0 -1.0 . . . . 0.93 109.54 -175.396 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 113.62 -35.02 4.73 Favored Glycine 0 N--CA 1.439 -1.122 0 CA-C-N 114.525 -1.216 . . . . 0.56 112.895 174.354 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 124.46 -170.86 16.57 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.664 -0.779 . . . . 0.49 111.691 -177.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.542 ' NE1' HD13 ' A' ' 142' ' ' ILE . 4.4 m-90 -78.54 -33.46 47.84 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.565 0.221 . . . . 3.57 111.099 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -65.28 -41.71 93.88 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.922 0.391 . . . . 1.96 110.309 178.707 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.462 ' O ' ' HB2' ' A' ' 153' ' ' GLU . 88.2 m -56.94 -35.85 69.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.868 -0.605 . . . . 0.67 111.197 177.085 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.606 ' CD2' ' HB3' ' A' ' 97' ' ' TRP . 53.5 t80 -58.92 -41.97 88.58 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.216 -0.447 . . . . 3.0 110.552 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.522 HG12 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -72.81 -25.75 22.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.098 0.475 . . . . 1.15 110.304 -179.039 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 150' ' ' THR . 62.0 mm-40 -60.81 -23.21 64.88 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.033 0.444 . . . . 1.67 110.551 173.272 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.525 ' HB2' ' CD1' ' A' ' 155' ' ' TYR . 0.5 OUTLIER -105.5 -54.27 2.51 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.887 -0.597 . . . . 1.3 110.956 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 155' ' ' TYR . . . . . 0.525 ' CD1' ' HB2' ' A' ' 154' ' ' LEU . 88.8 m-85 -110.61 14.51 22.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.643 -0.708 . . . . 4.24 111.242 -171.153 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.689 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -59.76 158.93 23.2 Favored Glycine 0 CA--C 1.504 -0.643 0 C-N-CA 121.251 -0.5 . . . . 1.1 113.629 -175.093 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 5.0 t30 . . . . . 0 C--N 1.316 -0.851 0 CA-C-N 113.94 -1.13 . . . . 1.29 110.947 178.751 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B 1005 ' ' GLY . . . . . 0.641 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.532 1.14 0 CA-C-O 120.942 0.19 . . . . 1.2 113.037 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -85.32 -47.8 9.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.103 0.478 . . . . 2.88 111.165 171.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -82.68 -52.74 6.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.829 -0.623 . . . . 1.31 112.543 -168.436 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1008 ' ' LEU . . . . . . . . . . . . . 3.9 mm? -59.58 -58.56 8.04 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 123.172 0.295 . . . . 1.33 110.542 -176.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1009 ' ' ALA . . . . . 0.976 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -32.35 -53.63 0.31 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 122.186 0.993 . . . . 0.88 112.059 170.534 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -68.69 -55.19 12.23 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 113.816 -1.538 . . . . 1.03 111.877 -176.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -64.7 -23.27 67.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.199 -0.455 . . . . 1.67 111.048 -178.338 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -72.19 -6.66 65.39 Favored Glycine 0 N--CA 1.446 -0.669 0 CA-C-N 116.006 -0.543 . . . . 0.78 112.831 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -80.87 -2.26 46.69 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 111.757 0.28 . . . . 1.9 111.757 177.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 2.4 m . . . . . 0 CA--C 1.53 0.191 0 O-C-N 121.793 -0.567 . . . . 1.44 111.419 -174.03 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.63 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 43.7 tp60 . . . . . 0 N--CA 1.455 -0.203 0 CA-C-O 121.264 0.554 . . . . 2.42 109.69 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.5 p -76.33 -16.21 59.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.805 -0.634 . . . . 1.25 110.249 177.726 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.814 ' HB3' HD13 ' A' ' 134' ' ' LEU . 51.5 m-20 -66.81 -19.82 65.82 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.462 -0.57 . . . . 1.78 109.462 175.205 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.63 ' HB2' ' O ' ' A' ' 3' ' ' GLN . 2.5 mmt85 -51.01 -51.02 57.22 Favored 'General case' 0 CA--C 1.509 -0.607 0 CA-C-N 115.417 -0.811 . . . . 1.4 110.522 176.257 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.438 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 43.5 mt-10 -56.38 -47.2 79.42 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.172 -0.922 . . . . 0.68 111.163 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.764 HD22 ' HA ' ' A' ' 5' ' ' ASN . 1.2 mp -51.44 -31.58 23.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.508 -0.769 . . . . 1.16 111.21 176.451 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.454 HG21 ' CA ' ' A' ' 131' ' ' ALA . 77.9 t -83.1 -67.05 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.55 0.691 . . . . 0.27 110.531 172.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 6' ' ' ARG . 51.1 t -50.28 -55.26 6.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.656 -1.156 . . . . 0.33 113.515 -172.852 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -50.73 -33.33 22.55 Favored 'General case' 0 C--O 1.234 0.246 0 O-C-N 123.635 0.584 . . . . 0.59 111.364 -174.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.651 ' HE1' ' HB3' ' A' ' 51' ' ' ARG . 98.9 m-85 -90.37 -35.57 15.12 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.838 -0.619 . . . . 1.61 112.37 -175.853 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 1.053 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 2.6 mp -60.12 -37.57 80.41 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 119.368 -0.933 . . . . 0.34 108.93 174.037 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.452 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 39.8 t -58.75 -44.98 90.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.278 -0.873 . . . . 1.05 110.68 175.134 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -66.9 -33.92 76.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.072 -0.513 . . . . 1.22 110.702 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.63 ' HG2' ' O ' ' A' ' 12' ' ' PHE . 8.5 mmpt? -68.97 -33.24 73.37 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.434 -0.348 . . . . 1.41 110.962 -178.495 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.628 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -73.2 -30.02 63.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.876 0.37 . . . . 1.35 110.434 176.447 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.6 t -62.44 -36.15 81.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.911 -0.586 . . . . 0.94 111.4 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -77.07 -1.91 31.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 1.37 111.664 -179.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.594 ' HE2' HG11 ' A' ' 112' ' ' VAL . 15.6 mmmt -111.75 -26.21 9.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.872 0.844 . . . . 2.2 109.227 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.69 23.14 8.96 Favored Glycine 0 N--CA 1.441 -0.982 0 CA-C-N 113.978 -1.465 . . . . 0.53 111.719 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.484 ' HE2' HE21 ' A' ' 120' ' ' GLN . 50.0 m-85 -113.66 164.69 13.36 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.023 -0.362 . . . . 0.76 110.023 175.526 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.607 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 2.1 t -111.57 143.68 42.06 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.975 -0.557 . . . . 0.52 109.833 176.358 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.452 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.8 OUTLIER -66.5 -48.75 68.82 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.229 -0.441 . . . . 3.36 110.117 174.631 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.484 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 3.9 p -64.36 -27.84 69.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.5 . . . . 1.37 111.919 -174.237 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.607 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 94.7 mt-30 -57.36 -33.65 68.01 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.203 0.525 . . . . 1.11 110.989 176.006 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.411 ' O ' ' HB2' ' A' ' 124' ' ' SER . 62.3 m-85 -120.09 14.86 12.34 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.604 -0.726 . . . . 1.28 111.319 -170.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.579 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 72.5 p -100.98 179.89 4.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 122.074 0.94 . . . . 1.81 112.94 -172.288 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.598 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 21.4 t70 -168.69 -20.28 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 113.182 -1.827 . . . . 2.31 107.933 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.884 HG23 ' H ' ' A' ' 31' ' ' GLU . 5.8 m -57.51 -71.8 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 114.171 -1.377 . . . . 0.92 112.669 -176.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.884 ' H ' HG23 ' A' ' 30' ' ' VAL . 24.2 mm-40 -87.82 -2.92 58.92 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.668 -0.864 . . . . 2.74 108.668 177.599 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.598 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 34.6 tt0 . . . . . 0 N--CA 1.437 -1.104 0 CA-C-N 114.6 -1.182 . . . . 1.45 109.378 -179.281 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 N--CA 1.444 -0.756 0 N-CA-C 113.19 0.811 . . . . 1.12 113.19 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -29.3 -32.55 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.713 1.205 . . . . 2.02 113.454 169.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.724 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 2.7 p -30.74 -49.03 0.12 Allowed 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 114.228 1.196 . . . . 1.25 114.228 -177.843 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -40.27 -50.93 2.76 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.748 0.648 . . . . 1.91 112.748 -173.308 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.39 -36.38 58.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.697 0.284 . . . . 0.52 111.519 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.577 ' HA ' HG12 ' A' ' 152' ' ' VAL . 1.0 OUTLIER -74.25 -39.05 49.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.632 -0.258 . . . . 1.41 111.344 -175.011 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.724 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.0 ptpt -67.37 -44.43 78.97 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.993 -0.743 . . . . 0.67 108.993 174.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.429 ' N ' ' HG3' ' A' ' 47' ' ' LYS . 16.1 mm-40 -54.12 -35.18 61.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.724 -0.671 . . . . 0.99 112.038 174.133 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.627 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -80.66 -30.94 36.52 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.105 0.479 . . . . 0.42 111.036 177.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.612 ' HG ' ' CE2' ' A' ' 104' ' ' PHE . 1.1 mp -68.34 -26.92 65.84 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.707 -0.679 . . . . 1.33 111.744 -176.586 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.651 ' HB3' ' HE1' ' A' ' 12' ' ' PHE . 5.3 ptp180 -80.83 -26.6 36.95 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.57 0.7 . . . . 2.17 109.26 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -71.5 -54.33 10.92 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.592 -1.186 . . . . 1.1 109.707 177.067 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.36 -39.31 93.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.724 -0.671 . . . . 0.53 110.454 176.563 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.701 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -58.22 -51.92 55.66 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.666 -0.697 . . . . 0.7 112.003 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.552 ' O ' HD22 ' A' ' 59' ' ' LEU . 17.8 t70 -53.33 -40.89 65.2 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.956 0.408 . . . . 1.04 111.226 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.523 ' O ' HD21 ' A' ' 59' ' ' LEU . 44.2 mt-10 -75.27 -25.34 57.93 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.453 -0.794 . . . . 2.29 111.645 -179.018 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.902 ' HZ ' ' HA2' ' B' 1012 ' ' GLY . 8.0 t80 -85.38 -46.95 10.46 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.74 0.644 . . . . 2.29 112.74 178.456 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.701 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 44.8 mt-10 -54.86 -52.12 63.81 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.737 0.643 . . . . 1.3 112.737 -166.296 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.581 HD23 ' N ' ' A' ' 59' ' ' LEU . 2.2 pt? -52.15 -34.25 43.94 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.196 -0.911 . . . . 1.54 111.697 -174.327 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 -55.35 -55.15 34.81 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.466 -0.334 . . . . 2.58 111.154 -178.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.613 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 47.4 p90 -93.03 -3.58 54.09 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.242 -0.435 . . . . 5.32 111.775 -178.442 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.632 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 41.6 ttm180 -50.87 -36.04 35.78 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.746 0.647 . . . . 4.48 112.746 -173.113 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -61.81 -31.59 71.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.605 0.24 . . . . 4.72 111.512 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.638 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.06 -47.8 7.6 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.567 0.58 . . . . 1.17 112.567 -174.489 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.632 ' CD1' ' HA ' ' A' ' 62' ' ' ARG . 5.7 p90 -58.47 -27.09 64.09 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.703 0.631 . . . . 2.81 112.703 -166.297 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.0 t -70.58 -31.59 68.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.151 0.5 . . . . 2.19 110.259 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -91.01 -24.96 19.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 2.72 111.008 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 59.9 mt -59.76 -16.69 29.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.915 0.709 . . . . 1.56 112.915 -174.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.658 HG22 HG13 ' A' ' 74' ' ' ILE . 16.6 p -50.91 -35.89 35.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.113 0.482 . . . . 0.7 111.113 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 13.4 t -67.01 -34.72 78.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.402 -0.817 . . . . 1.34 110.755 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -78.54 -49.06 13.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.776 -0.647 . . . . 1.42 110.289 -177.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.723 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.1 mt -67.06 -30.64 70.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.397 -0.819 . . . . 1.37 110.196 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.1 m80 68.58 61.31 0.36 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.922 0.868 . . . . 2.72 109.191 -177.366 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.658 HG13 HG22 ' A' ' 69' ' ' THR . 16.0 mm -64.93 123.54 17.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 114.009 -1.45 . . . . 0.91 110.926 -178.662 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.773 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.1 -169.35 0.22 Allowed Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 107.515 -1.291 . . . . 0.51 107.515 -169.872 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.773 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.5 Cg_exo -30.5 166.26 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.272 0 C-N-CA 124.722 3.614 . . . . 0.47 114.875 164.69 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.24 -28.93 0.01 OUTLIER Glycine 0 N--CA 1.476 1.331 0 N-CA-C 117.089 1.596 . . . . 0.4 117.089 -175.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.455 ' N ' ' O ' ' A' ' 76' ' ' PRO . 22.1 p -69.27 6.53 0.97 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 117.693 0.747 . . . . 0.56 111.695 178.222 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.3 -14.23 62.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.391 -0.596 . . . . 0.34 109.391 169.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -75.48 -16.81 60.27 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.649 -0.705 . . . . 4.13 109.348 174.254 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.491 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 76.5 mt-30 -83.8 -27.01 29.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.947 0.879 . . . . 1.03 109.635 173.489 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.723 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.8 m -72.1 -52.45 16.74 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.646 -1.161 . . . . 0.48 109.187 171.739 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.438 ' HB2' ' HG ' ' A' ' 110' ' ' LEU . 75.6 t80 -65.03 -16.1 63.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.887 -1.051 . . . . 1.18 110.005 174.481 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.65 ' HA ' HG12 ' A' ' 87' ' ' VAL . 34.1 tt0 -62.95 -50.14 71.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.975 0.416 . . . . 0.8 110.288 176.247 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -44.32 -45.55 8.8 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 114.793 -1.094 . . . . 1.62 111.343 179.236 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.637 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.4 p -90.44 -39.21 11.79 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 CA-C-N 113.42 -1.718 . . . . 1.3 111.77 -171.731 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.65 HG12 ' HA ' ' A' ' 84' ' ' GLU . 5.3 p -64.86 -23.4 33.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.894 0.854 . . . . 0.85 109.063 176.718 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.1 m-80 -70.49 -46.09 64.4 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.309 -1.314 . . . . 0.91 111.345 175.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 1.029 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.7 OUTLIER -69.14 -36.4 77.41 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 108.59 -0.893 . . . . 2.87 108.59 -179.222 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.633 HD12 ' HD2' ' A' ' 99' ' ' ARG . 1.1 tp -69.58 -20.16 63.65 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 113.797 -1.547 . . . . 1.28 111.783 -168.671 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.6 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 2.5 p90 -110.66 -12.3 14.34 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.441 -0.503 . . . . 2.3 111.569 -175.474 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.57 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 9.0 ptm180 -98.46 -35.47 10.25 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.388 0.613 . . . . 5.06 110.988 -179.049 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -82.93 5.05 23.24 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.323 -0.853 . . . . 3.12 112.587 -167.125 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 131.26 67.49 0.1 OUTLIER Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 117.83 -2.129 . . . . 2.31 114.724 -177.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.6 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 57.3 t -72.71 95.86 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 122.056 0.931 . . . . 1.06 111.307 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -113.19 -171.0 1.79 Allowed 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.425 -1.261 . . . . 2.12 108.868 173.656 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.615 ' HB3' ' HE2' ' A' ' 155' ' ' TYR . 15.7 m-90 -53.39 -54.23 39.77 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 123.475 0.484 . . . . 3.34 111.345 -179.544 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.431 ' O ' ' HB ' ' A' ' 101' ' ' VAL . . . -77.17 -16.59 80.47 Favored Glycine 0 CA--C 1.52 0.381 0 C-N-CA 121.093 -0.575 . . . . 0.69 113.775 -175.334 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.649 HH12 ' HA ' ' B' 1009 ' ' ALA . 7.5 tpp180 -67.36 -43.02 82.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.066 0.46 . . . . 4.24 110.464 -178.683 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.421 ' CD1' ' HG ' ' A' ' 138' ' ' LEU . 85.5 mt -69.86 -31.78 49.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.3 0.572 . . . . 0.44 110.488 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.619 ' HA ' ' CD2' ' A' ' 104' ' ' PHE . 59.8 t -52.96 -51.72 35.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.35 -0.841 . . . . 1.35 110.352 172.42 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.406 ' HB2' ' CE1' ' A' ' 57' ' ' PHE . . . -55.31 -47.61 75.36 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.657 -0.701 . . . . 0.44 110.841 175.0 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -57.32 -50.71 72.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.315 -0.857 . . . . 1.49 112.357 -178.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.619 ' CD2' ' HA ' ' A' ' 101' ' ' VAL . 1.2 p90 -66.86 -36.18 81.73 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 120.584 -0.446 . . . . 3.29 110.404 -176.035 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 44.5 m -68.4 -40.73 81.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.253 -0.43 . . . . 1.19 110.501 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -71.56 -34.52 70.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.883 -0.599 . . . . 2.89 110.402 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.491 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -62.49 -42.01 99.74 Favored Glycine 0 N--CA 1.444 -0.823 0 C-N-CA 120.367 -0.921 . . . . 0.3 110.89 174.271 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 1.053 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.29 -28.32 73.43 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.788 -0.72 . . . . 0.23 111.683 174.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.97 -35.12 50.59 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.907 -0.172 . . . . 0.31 110.636 176.735 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.438 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -59.64 -38.81 82.39 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 107.904 -1.146 . . . . 1.12 107.904 178.411 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.781 ' HB2' HD23 ' A' ' 13' ' ' LEU . 26.2 t -49.14 -63.12 1.19 Allowed 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 113.406 -1.725 . . . . 0.26 109.824 171.605 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.94 ' HA ' HG13 ' A' ' 115' ' ' VAL . 42.5 t -62.27 -34.52 64.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 0.35 111.667 -177.314 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.495 ' C ' HG21 ' A' ' 74' ' ' ILE . 32.8 mt-10 -57.0 -23.51 46.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.055 0.455 . . . . 2.51 110.278 178.23 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.419 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 54.3 m -85.93 -43.62 13.07 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 108.479 -0.934 . . . . 0.28 108.479 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.94 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.8 m -69.0 -29.04 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 CA-C-N 114.93 -1.032 . . . . 1.23 109.787 -176.055 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -50.53 -49.93 54.49 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 113.165 -1.834 . . . . 0.6 110.995 174.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -86.81 11.19 13.8 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.554 -0.748 . . . . 1.62 110.019 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 64.03 52.75 1.98 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 122.146 0.974 . . . . 1.88 110.137 -175.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.419 ' CE ' ' HA ' ' A' ' 114' ' ' SER . 30.3 mtm -129.9 36.92 4.0 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.075 -1.42 . . . . 0.31 107.531 179.118 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.78 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 11.7 mp0 -53.84 -7.95 0.15 Allowed 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.637 -1.165 . . . . 1.15 113.24 -178.353 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.51 HG23 HD22 ' A' ' 122' ' ' LEU . 20.9 m -67.06 -20.51 27.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 O-C-N 121.671 -0.643 . . . . 0.46 111.997 175.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.699 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -75.05 -25.07 58.38 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.029 0.442 . . . . 0.26 110.077 177.874 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.737 HG22 ' SG ' ' A' ' 111' ' ' CYS . 42.3 t -45.52 -51.87 2.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.617 -1.174 . . . . 0.25 112.355 -177.652 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.579 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 7.1 t -75.24 -34.27 61.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.884 0.374 . . . . 1.35 110.76 -178.38 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.699 ' HD2' HD13 ' A' ' 122' ' ' LEU . 74.2 mtt180 -64.06 -51.39 64.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.445 . . . . 2.67 110.591 -176.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.547 HG22 ' SD ' ' A' ' 130' ' ' MET . 73.4 mt -53.97 -50.05 56.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.572 -0.74 . . . . 0.23 111.155 178.73 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -53.73 -36.11 61.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.893 0.378 . . . . 0.29 111.517 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -61.5 -56.99 13.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.555 0.693 . . . . 0.28 110.674 176.762 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -65.31 -32.01 73.44 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.809 -1.087 . . . . 3.91 111.334 -176.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.547 ' SD ' HG22 ' A' ' 126' ' ' ILE . 90.3 mtp -64.51 -54.29 34.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.907 0.384 . . . . 1.08 111.277 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.454 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -61.69 -41.02 97.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.027 -0.533 . . . . 0.25 111.151 -178.026 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 59.7 m -65.73 -43.24 89.65 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.808 -0.357 . . . . 0.4 110.782 176.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.582 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 16.7 t80 -56.64 -40.11 74.88 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.707 -0.479 . . . . 3.13 109.707 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.865 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.2 tt -61.1 -55.91 27.08 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.827 -0.805 . . . . 0.95 108.827 172.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -50.63 -46.86 58.5 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.388 -0.823 . . . . 0.46 112.862 -176.209 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -87.03 -47.43 8.94 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.127 0.489 . . . . 0.59 111.8 -174.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' HIS . . . . . 0.582 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 66.8 m-70 -90.17 -50.89 5.74 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.829 -0.623 . . . . 1.45 112.253 -170.174 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.865 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -85.07 -44.84 12.66 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 113.555 0.946 . . . . 1.2 113.555 -168.52 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.628 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 29.6 tt0 -45.18 -51.25 25.41 Favored Pre-proline 0 C--N 1.32 -0.701 0 O-C-N 123.699 0.625 . . . . 0.75 112.596 -174.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.581 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 46.5 Cg_exo -55.7 -47.67 24.15 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 121.673 1.582 . . . . 0.56 111.591 175.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' TRP . . . . . 0.439 ' O ' ' HB2' ' A' ' 144' ' ' GLU . 0.1 OUTLIER -57.43 -48.18 79.83 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.507 -0.77 . . . . 1.2 110.387 177.586 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.618 HD12 ' HA ' ' A' ' 139' ' ' GLU . 19.1 mt -51.54 -49.43 33.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.665 -0.698 . . . . 0.32 111.531 175.26 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.628 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 80.5 mm-40 -60.98 -29.71 69.84 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.773 -0.649 . . . . 0.57 111.263 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 13.2 mm-40 -64.57 -20.17 66.08 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 121.439 0.637 . . . . 0.78 110.571 174.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -105.83 3.58 28.84 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.279 -0.873 . . . . 0.93 109.517 -175.56 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.15 -30.47 6.76 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.157 -0.929 . . . . 0.56 113.229 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' GLY . . . . . 0.423 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 113.42 159.72 13.65 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.252 -0.739 . . . . 0.49 111.252 -175.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.493 ' HB3' ' CB ' ' A' ' 46' ' ' VAL . 81.4 m95 -55.74 -30.77 61.75 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.491 0.552 . . . . 3.57 112.491 -174.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.525 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 14.1 p-10 -63.32 -41.29 98.91 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.669 -0.412 . . . . 1.96 109.955 177.898 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.543 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 54.3 m -65.94 -32.53 74.08 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.841 -0.618 . . . . 0.67 110.768 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.706 ' HD2' ' HH ' ' A' ' 155' ' ' TYR . 4.1 m-85 -60.28 -41.94 94.4 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.004 -0.544 . . . . 3.0 110.13 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.577 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -77.09 -25.28 15.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.155 0.503 . . . . 1.15 110.233 177.788 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 8.9 mm-40 -58.74 -20.82 52.68 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 121.967 -0.458 . . . . 1.67 110.124 173.11 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 150' ' ' THR . 2.6 mt -99.36 -55.62 2.63 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.884 -0.598 . . . . 1.3 110.419 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 155' ' ' TYR . . . . . 0.706 ' HH ' ' HD2' ' A' ' 151' ' ' PHE . 26.8 p90 -121.89 30.24 6.74 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.626 0.727 . . . . 4.24 112.402 -173.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.627 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -66.52 163.58 42.96 Favored Glycine 0 C--N 1.303 -1.291 0 CA-C-N 114.804 -1.089 . . . . 1.1 113.738 -177.794 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.423 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 9.6 t30 . . . . . 0 C--N 1.314 -0.976 0 CA-C-N 113.604 -1.298 . . . . 1.29 112.088 -177.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.389 0 N-CA-C 113.981 0.353 . . . . 1.2 113.981 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -107.21 -44.73 4.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 117.329 0.564 . . . . 2.88 112.446 175.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1007 ' ' ALA . . . . . 0.41 ' HB3' HD12 ' B' 1008 ' ' LEU . . . -58.57 -64.24 1.0 Allowed 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 113.046 0.758 . . . . 1.31 113.046 -165.613 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.699 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 4.3 mp -71.0 -36.09 72.33 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-N 116.514 -0.312 . . . . 1.33 110.352 -172.355 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B 1009 ' ' ALA . . . . . 1.029 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -42.28 -45.21 4.12 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.38 -0.827 . . . . 0.88 110.245 168.515 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -77.16 -40.41 45.54 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.463 -1.244 . . . . 1.03 111.681 -178.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -74.6 -30.27 61.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.784 0.326 . . . . 1.67 111.312 -177.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1012 ' ' GLY . . . . . 0.902 ' HA2' ' HZ ' ' A' ' 57' ' ' PHE . . . -71.63 -11.45 72.81 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 116.07 -0.514 . . . . 0.78 112.79 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.88 -17.11 60.63 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.171 0.51 . . . . 1.9 110.311 174.523 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 9.4 m . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 121.291 0.567 . . . . 1.44 110.304 -178.793 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 . . . . . 0 CA--C 1.529 0.167 0 N-CA-C 111.966 0.358 . . . . 2.42 111.966 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -60.1 -24.35 64.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.133 -0.485 . . . . 1.25 111.273 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.544 ' HB2' HD13 ' A' ' 134' ' ' LEU . 6.2 p30 -57.45 -30.08 64.73 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.898 -0.592 . . . . 1.78 111.601 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.438 ' O ' HG23 ' A' ' 10' ' ' VAL . 18.5 tpp85 -55.51 -49.92 71.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.895 -0.593 . . . . 1.4 110.959 178.506 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -60.71 -43.13 98.21 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.679 -0.691 . . . . 0.68 111.596 -176.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.567 HD21 ' HB3' ' A' ' 43' ' ' SER . 4.8 mt -63.3 -34.84 78.57 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.237 -0.892 . . . . 1.16 109.534 -175.442 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.511 HG13 ' HE2' ' A' ' 130' ' ' MET . 53.4 t -68.63 -63.83 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 115.51 -0.768 . . . . 0.27 109.586 173.317 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 6' ' ' ARG . 97.9 t -49.55 -55.06 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.371 -0.831 . . . . 0.33 113.033 -176.04 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -57.66 -33.25 68.12 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.201 0.313 . . . . 0.59 111.067 -173.549 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.667 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 20.4 t80 -83.64 -39.32 20.41 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 120.573 -0.451 . . . . 1.61 111.464 -177.617 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.992 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.0 mp -58.04 -40.34 80.68 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 119.666 -0.813 . . . . 0.34 109.286 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.443 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 47.8 t -60.08 -41.72 93.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.428 -0.806 . . . . 1.05 110.548 175.476 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -66.08 -30.47 70.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.908 -0.587 . . . . 1.22 110.935 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.825 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 14.8 mmmt -73.05 -48.67 34.0 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 121.453 0.644 . . . . 1.41 109.852 -178.378 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.639 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . 10.8 mt -56.54 -33.27 65.92 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.516 -0.765 . . . . 1.35 111.002 172.339 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.8 t -68.23 -24.81 64.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.876 -0.602 . . . . 0.94 111.893 -178.775 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.825 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 23.2 pt20 -77.18 -16.65 59.02 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-O 121.395 0.617 . . . . 1.37 110.304 -177.335 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.696 ' HD2' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -105.04 -24.62 12.78 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.943 -1.026 . . . . 2.2 109.365 -179.364 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.04 23.14 8.74 Favored Glycine 0 N--CA 1.439 -1.115 0 CA-C-N 114.189 -1.369 . . . . 0.53 112.936 176.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -99.22 164.58 12.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.737 0.304 . . . . 0.76 110.295 172.661 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.1 t -103.22 148.28 25.99 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.145 0.497 . . . . 0.52 110.671 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.651 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 58.3 t-105 -75.53 -54.26 7.29 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.433 -0.803 . . . . 3.36 109.557 174.509 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.1 m -62.4 -32.8 73.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.703 -0.68 . . . . 1.37 111.948 -173.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -60.29 -28.83 68.4 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 111.921 0.341 . . . . 1.11 111.921 -178.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -117.27 -2.44 11.61 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.222 0.453 . . . . 1.28 112.222 -175.036 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.628 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 51.5 m -102.04 155.48 18.15 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-O 122.155 0.978 . . . . 1.81 113.181 -175.816 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -130.79 -0.22 4.29 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 113.321 -1.763 . . . . 2.31 109.163 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.888 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.9 m -59.99 -75.68 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.434 -1.257 . . . . 0.92 113.239 -167.32 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.888 ' H ' HG23 ' A' ' 30' ' ' VAL . 33.1 mm-40 -92.03 -2.9 56.44 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.679 -0.859 . . . . 2.74 108.679 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 . . . . . 0 N--CA 1.448 -0.543 0 CA-C-N 114.717 -1.129 . . . . 1.45 110.711 177.188 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.874 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.8 t . . . . . 0 CA--C 1.544 0.74 0 N-CA-C 110.371 -0.233 . . . . 1.12 110.371 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.874 ' H ' HG23 ' A' ' 41' ' ' THR . 11.1 pt-20 -94.08 -30.44 14.66 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 123.011 1.386 . . . . 2.02 107.783 165.701 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.6 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.0 OUTLIER -60.86 -25.66 66.83 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 112.135 -2.302 . . . . 1.25 113.43 -171.245 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -53.08 -51.36 62.07 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 120.758 0.313 . . . . 1.91 110.635 179.227 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.548 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -74.62 -35.6 62.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.07 0.462 . . . . 0.52 110.212 178.301 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.704 ' HA ' ' CG1' ' A' ' 152' ' ' VAL . 95.1 t -58.91 -60.42 2.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.295 -0.866 . . . . 1.41 111.372 179.074 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.579 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 11.6 ptpt -59.36 -35.57 74.15 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.258 -0.645 . . . . 0.67 109.258 -178.706 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.563 ' OE1' ' HD2' ' A' ' 51' ' ' ARG . 4.9 mm-40 -66.63 -30.33 70.58 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.404 -0.817 . . . . 0.99 110.654 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.804 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -83.5 -38.46 21.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.243 0.544 . . . . 0.42 110.463 176.173 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.513 HD12 ' CE2' ' A' ' 151' ' ' PHE . 0.8 OUTLIER -65.88 -27.31 68.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.382 -0.827 . . . . 1.33 111.576 -176.368 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 6.4 ptp180 -81.41 -24.11 37.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.385 0.612 . . . . 2.17 109.494 -178.169 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -75.49 -44.97 41.15 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.927 -1.033 . . . . 1.1 109.271 174.701 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.78 -43.58 95.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.512 -0.767 . . . . 0.53 109.885 173.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.645 ' O ' ' HG2' ' A' ' 58' ' ' GLU . . . -65.73 -32.82 84.21 Favored Glycine 0 C--O 1.221 -0.663 0 CA-C-N 115.356 -0.838 . . . . 0.7 112.058 177.301 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -57.96 -48.02 81.22 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.842 -0.429 . . . . 1.04 109.842 178.093 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -66.42 -27.33 67.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.339 -0.846 . . . . 2.29 111.17 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.619 ' CE2' ' HA ' ' A' ' 102' ' ' ALA . 5.4 t80 -80.76 -27.86 36.64 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.32 -0.4 . . . . 2.29 111.47 -178.222 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.645 ' HG2' ' O ' ' A' ' 54' ' ' GLY . 36.9 mm-40 -49.82 -69.04 0.13 Allowed 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 112.216 0.451 . . . . 1.3 112.216 -178.471 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.809 HD13 ' H ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -53.98 -35.45 61.84 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.248 -0.887 . . . . 1.54 111.343 -179.443 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.711 ' N ' HD22 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -51.63 -62.07 1.85 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.607 -0.724 . . . . 2.58 112.33 175.681 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.454 ' HD1' ' HB3' ' A' ' 65' ' ' PHE . 31.1 p90 -90.98 -11.41 39.01 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 112.022 0.378 . . . . 5.32 112.022 -175.444 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.757 ' HG3' ' HE1' ' A' ' 65' ' ' PHE . 43.0 ttm180 -62.38 -29.72 70.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.674 0.273 . . . . 4.48 111.277 -175.806 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -64.84 -35.14 80.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.345 -0.389 . . . . 4.72 110.622 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.408 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -91.52 -50.4 5.8 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.396 0.517 . . . . 1.17 112.396 -176.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.971 ' HA ' ' HB2' ' A' ' 68' ' ' LEU . 1.3 p90 -57.59 -27.32 62.61 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 112.581 0.586 . . . . 2.81 112.581 -166.59 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.6 p -64.29 -33.35 75.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.01 0.433 . . . . 2.19 110.539 177.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -90.28 -32.45 16.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.496 0.665 . . . . 2.72 109.738 174.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.971 ' HB2' ' HA ' ' A' ' 65' ' ' PHE . 3.3 mp -60.1 -19.73 54.79 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-N 115.205 -0.907 . . . . 1.56 112.506 -177.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.663 HG22 HG13 ' A' ' 74' ' ' ILE . 1.3 p -58.15 -28.43 64.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 118.29 0.496 . . . . 0.7 111.114 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 21.8 t -71.53 -37.3 71.19 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 109.365 -0.606 . . . . 1.34 109.365 173.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.45 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 46.1 mt-30 -68.44 -40.18 81.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.432 -0.804 . . . . 1.42 110.088 178.614 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.443 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.0 mm? -68.72 -32.56 72.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.609 -0.269 . . . . 1.37 110.64 172.542 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.5 m80 60.84 49.23 6.19 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.476 -0.935 . . . . 2.72 108.476 -170.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.663 HG13 HG22 ' A' ' 69' ' ' THR . 33.1 mm -51.3 113.05 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 113.805 -1.543 . . . . 0.91 112.325 -176.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.775 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -154.55 -172.93 0.34 Allowed Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 107.522 -1.288 . . . . 0.51 107.522 -171.804 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.775 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.4 Cg_exo -29.91 166.28 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.332 0 C-N-CA 125.185 3.923 . . . . 0.47 115.466 166.224 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.514 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.26 -31.2 0.01 OUTLIER Glycine 0 N--CA 1.472 1.048 0 N-CA-C 117.307 1.683 . . . . 0.4 117.307 -173.233 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 76' ' ' PRO . 18.2 p -66.14 2.03 1.3 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 117.653 0.726 . . . . 0.56 112.243 -179.065 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.25 -12.46 61.69 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.182 0.515 . . . . 0.34 110.012 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.509 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 5.5 p90 -73.58 -21.76 60.25 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 109.212 -0.662 . . . . 4.13 109.212 175.088 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.458 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 37.4 mt-30 -80.82 -25.58 37.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.867 0.841 . . . . 1.03 109.553 175.186 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.9 m -71.34 -51.67 22.96 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 114.482 -1.235 . . . . 0.48 109.524 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.598 ' HE1' ' HB2' ' A' ' 106' ' ' PHE . 78.5 t80 -68.87 -18.65 64.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.057 -0.974 . . . . 1.18 110.467 176.813 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.619 ' HA ' HG12 ' A' ' 87' ' ' VAL . 37.4 tt0 -59.51 -49.25 78.5 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.391 -0.822 . . . . 0.8 110.339 176.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.403 ' HG3' ' H ' ' A' ' 85' ' ' GLN . 66.1 mt-30 -48.45 -32.6 7.99 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.805 -1.089 . . . . 1.62 110.737 176.089 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.784 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -83.83 -53.07 11.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.803 -1.09 . . . . 1.3 110.815 -177.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.619 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.6 p -61.44 -23.92 32.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.492 0.663 . . . . 0.85 109.602 -179.057 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.695 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.6 m-80 -68.47 -52.77 28.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.581 -1.191 . . . . 0.91 111.102 174.11 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.937 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.8 OUTLIER -63.22 -36.54 83.98 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 121.881 0.848 . . . . 2.87 108.762 -178.303 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.637 ' HG ' ' CD ' ' A' ' 89' ' ' GLU . 19.1 mt -68.89 -22.35 64.19 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 113.731 -1.577 . . . . 1.28 112.527 -167.489 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.73 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 5.6 p90 -106.79 -32.11 8.1 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 120.494 -0.483 . . . . 2.3 111.842 -174.309 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.695 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.0 OUTLIER -81.54 -24.41 36.62 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.243 0.544 . . . . 5.06 110.854 -172.689 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.474 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 0.4 OUTLIER -98.53 18.52 16.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.518 -0.764 . . . . 3.12 112.713 -170.249 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 116.19 68.88 0.42 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 117.829 -2.129 . . . . 2.31 114.756 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.73 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 63.5 t -70.49 105.39 1.42 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 CA-C-N 118.276 1.038 . . . . 1.06 111.277 -176.293 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.467 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 3.5 p30 -110.12 -170.66 1.69 Allowed 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 113.675 -1.602 . . . . 2.12 108.229 172.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.828 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 23.2 m-90 -62.86 -35.06 78.73 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.84 0.352 . . . . 3.34 110.633 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.452 ' HA2' HG13 ' A' ' 101' ' ' VAL . . . -73.75 -38.47 50.05 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.996 -0.547 . . . . 0.69 113.697 -176.282 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.467 ' HG2' ' ND2' ' A' ' 96' ' ' ASN . 16.1 mmt180 -54.19 -31.74 53.75 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.225 0.536 . . . . 4.24 111.563 -178.515 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.429 HG12 ' HG ' ' A' ' 138' ' ' LEU . 78.9 mt -83.19 -34.16 10.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.954 -0.566 . . . . 0.44 111.653 -174.611 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.452 HG13 ' HA2' ' A' ' 98' ' ' GLY . 1.1 m -66.93 -25.97 35.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 109.344 -0.613 . . . . 1.35 109.344 171.491 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.619 ' HA ' ' CE2' ' A' ' 57' ' ' PHE . . . -68.5 -51.87 38.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.194 0.521 . . . . 0.44 109.71 172.474 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -49.37 -54.56 16.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.5 -1.227 . . . . 1.49 111.936 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.507 ' HA ' ' CE ' ' A' ' 130' ' ' MET . 0.3 OUTLIER -73.49 -19.08 61.03 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 120.645 -0.422 . . . . 3.29 111.441 -172.844 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.667 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 67.9 m -77.31 -49.27 15.35 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.509 0.195 . . . . 1.19 110.653 177.705 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.651 ' CZ ' HD12 ' B' 1008 ' ' LEU . 19.2 m-85 -60.51 -39.55 88.18 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 110.092 -0.336 . . . . 2.89 110.092 177.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.893 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.99 -38.98 94.63 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.875 -0.678 . . . . 0.3 111.959 177.462 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.992 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.6 -40.8 99.04 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.612 -0.804 . . . . 0.23 111.362 175.541 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.13 -32.2 66.71 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.771 0.32 . . . . 0.31 110.76 177.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.544 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -58.31 -39.89 80.58 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 108.377 -0.972 . . . . 1.12 108.377 179.48 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.75 ' SG ' HG22 ' A' ' 123' ' ' VAL . 40.1 t -51.25 -64.11 0.92 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 113.713 -1.585 . . . . 0.26 110.247 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.835 ' HA ' HG13 ' A' ' 115' ' ' VAL . 44.6 t -61.57 -37.17 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-N 116.508 -0.314 . . . . 0.35 111.826 -175.365 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.476 ' HG3' ' CG2' ' A' ' 69' ' ' THR . 4.0 mm-40 -60.21 -21.81 62.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.105 0.479 . . . . 2.51 110.67 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.435 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 70.3 m -83.74 -42.77 16.19 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 108.061 -1.088 . . . . 0.28 108.061 179.071 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.835 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.6 m -68.9 -28.79 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-N 114.796 -1.093 . . . . 1.23 109.515 -177.44 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -51.67 -51.03 59.1 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 113.26 -1.791 . . . . 0.6 110.919 174.32 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 15.5 mmtp -84.7 13.92 5.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.523 -0.762 . . . . 1.62 110.285 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 65.31 46.12 2.71 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.95 0.881 . . . . 1.88 109.976 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.435 ' CE ' ' HA ' ' A' ' 114' ' ' SER . 26.8 mtm -126.7 38.24 4.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.559 -1.201 . . . . 0.31 107.889 -178.438 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.753 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 10.2 mp0 -54.68 -8.05 0.21 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 114.775 -1.102 . . . . 1.15 113.048 -179.367 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.582 HG23 HD22 ' A' ' 122' ' ' LEU . 16.5 m -64.0 -27.56 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 O-C-N 121.831 -0.543 . . . . 0.46 111.477 174.051 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.582 HD22 HG23 ' A' ' 121' ' ' VAL . 3.2 mm? -70.04 -25.48 63.58 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 110.235 -0.284 . . . . 0.26 110.235 178.375 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.75 HG22 ' SG ' ' A' ' 111' ' ' CYS . 55.2 t -47.7 -51.38 7.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.587 -0.733 . . . . 0.25 111.819 -178.549 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.628 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 14.6 t -75.62 -31.48 59.89 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.881 0.372 . . . . 1.35 110.598 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.499 ' NH1' ' HA3' ' A' ' 77' ' ' GLY . 58.6 mtp180 -66.42 -55.25 16.66 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 116.205 -0.452 . . . . 2.67 110.418 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.544 HD13 ' HB3' ' A' ' 110' ' ' LEU . 87.7 mt -53.64 -42.82 52.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.591 -0.731 . . . . 0.23 111.799 -175.843 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.651 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -60.27 -35.0 74.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.923 -0.311 . . . . 0.29 110.89 178.371 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -64.15 -59.76 4.04 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.636 0.731 . . . . 0.28 109.832 176.305 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.495 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 94.3 m95 -54.05 -46.15 71.86 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.251 -1.34 . . . . 3.91 110.437 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.893 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 1.4 mmm -59.15 -59.41 5.51 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.784 -0.644 . . . . 1.08 112.067 -177.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -59.81 -36.05 75.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 120.685 -0.406 . . . . 0.25 110.392 -177.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.429 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 23.3 m -64.49 -49.22 72.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.601 -0.272 . . . . 0.4 111.571 176.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.486 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 14.1 m-85 -58.0 -36.37 72.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.766 0.317 . . . . 3.13 110.351 178.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.733 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.5 tt -64.85 -51.06 64.09 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.986 -0.746 . . . . 0.95 108.986 171.81 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' ASN . . . . . 0.429 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 4.5 m-80 -48.7 -49.59 37.2 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.07 0.548 . . . . 0.46 112.034 178.392 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -80.15 -50.59 10.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.258 -0.428 . . . . 0.59 111.897 -174.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' HIS . . . . . 0.486 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 22.2 m-70 -90.69 -51.69 5.25 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.067 0.765 . . . . 1.45 113.067 -170.875 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.733 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -82.71 -45.89 13.87 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.291 0.848 . . . . 1.2 113.291 -167.078 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.69 ' HA ' HD12 ' A' ' 142' ' ' ILE . 22.8 tt0 -42.08 -53.64 8.24 Favored Pre-proline 0 CA--C 1.542 0.652 0 O-C-N 124.123 0.89 . . . . 0.75 113.167 -172.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.49 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 19.3 Cg_endo -61.09 -47.6 12.12 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.889 1.726 . . . . 0.56 111.998 178.749 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -55.37 -46.92 76.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.72 -0.673 . . . . 1.2 110.065 177.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.69 HD12 ' HA ' ' A' ' 139' ' ' GLU . 48.4 mt -49.08 -52.06 11.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.793 -0.64 . . . . 0.32 111.798 175.644 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.8 mm-40 -59.9 -30.67 69.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.984 -0.553 . . . . 0.57 111.434 -179.061 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.7 mm-40 -65.63 -20.81 66.46 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.705 0.764 . . . . 0.78 110.594 176.582 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -111.29 10.92 21.67 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.002 -0.999 . . . . 0.93 109.917 -175.698 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 114.39 -46.84 1.11 Allowed Glycine 0 N--CA 1.44 -1.044 0 CA-C-N 114.861 -1.063 . . . . 0.56 112.813 173.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' GLY . . . . . 0.581 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 131.56 178.46 15.49 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.717 -0.754 . . . . 0.49 111.9 -177.536 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.525 ' NE1' HD13 ' A' ' 142' ' ' ILE . 7.0 m-90 -68.54 -41.9 79.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.62 0.248 . . . . 3.57 110.778 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.43 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 23.3 t70 -59.84 -37.75 80.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.32 0.581 . . . . 1.96 109.862 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.644 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 62.2 m -60.93 -37.53 82.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.306 -0.861 . . . . 0.67 111.183 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.828 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 74.6 t80 -59.33 -40.53 86.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.059 0.457 . . . . 3.0 109.954 177.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.704 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -74.6 -24.89 18.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.475 0.655 . . . . 1.15 110.094 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 31.8 mm-40 -66.38 -22.9 66.25 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.396 0.617 . . . . 1.67 110.082 172.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.644 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.7 mt -93.82 -58.53 2.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.648 -0.705 . . . . 1.3 110.552 177.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -122.07 30.16 6.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.047 -0.524 . . . . 4.24 111.594 -173.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.804 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -62.95 155.72 41.87 Favored Glycine 0 CA--C 1.502 -0.764 0 CA-C-O 121.654 0.585 . . . . 1.1 113.682 -177.437 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.431 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 2.5 t30 . . . . . 0 C--N 1.312 -1.059 0 CA-C-N 113.842 -1.179 . . . . 1.29 110.283 175.466 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1005 ' ' GLY . . . . . 0.79 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.53 1.008 0 CA-C-O 120.754 0.085 . . . . 1.2 112.954 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -89.23 -51.47 5.56 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.846 0.355 . . . . 2.88 111.281 174.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -69.07 -62.83 1.22 Allowed 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 113.244 0.831 . . . . 1.31 113.244 -167.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.651 HD12 ' CZ ' ' A' ' 106' ' ' PHE . 3.2 mm? -58.63 -53.23 60.72 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.149 -0.315 . . . . 1.33 110.149 -176.307 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B 1009 ' ' ALA . . . . . 0.937 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -38.0 -50.43 1.33 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.102 -0.954 . . . . 0.88 111.991 171.142 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -70.2 -47.88 59.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.084 -0.962 . . . . 1.03 111.706 -177.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -66.52 -27.42 67.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.007 0.432 . . . . 1.67 111.247 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.67 -11.14 80.54 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.939 -0.573 . . . . 0.78 112.905 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 36.0 t70 -76.51 -5.32 47.04 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.17 0.509 . . . . 1.9 110.647 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 10.0 m . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 116.09 -0.505 . . . . 1.44 111.053 -177.721 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 120.69 0.281 . . . . 2.42 110.812 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.1 t -86.67 -22.58 26.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.963 0.411 . . . . 1.25 110.731 -177.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.783 ' HA ' HD22 ' A' ' 8' ' ' LEU . 8.2 p30 -67.75 -22.66 65.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.106 0.479 . . . . 1.78 110.05 173.236 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.965 HH12 ' HA ' ' A' ' 128' ' ' ALA . 21.1 tpp180 -55.56 -49.6 72.26 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 115.263 -0.88 . . . . 1.4 109.778 175.779 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -56.3 -52.28 65.09 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.475 -1.239 . . . . 0.68 111.176 -177.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.783 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.8 OUTLIER -44.54 -43.73 8.21 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.269 -0.878 . . . . 1.16 111.167 175.733 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.461 HG13 ' HE2' ' A' ' 130' ' ' MET . 76.1 t -72.17 -61.41 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.337 0.589 . . . . 0.27 110.482 176.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 6' ' ' ARG . 68.2 t -52.91 -52.71 26.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.062 -0.972 . . . . 0.33 113.036 -174.183 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -55.7 -34.52 65.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.066 0.46 . . . . 0.59 110.549 -175.343 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.696 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 24.2 t80 -80.38 -43.01 21.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 116.102 -0.499 . . . . 1.61 111.132 -178.052 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.834 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 3.9 mp -59.02 -41.63 88.24 Favored 'General case' 0 CA--C 1.522 -0.113 0 C-N-CA 120.066 -0.654 . . . . 0.34 109.526 176.408 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -55.58 -43.21 75.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.641 -0.709 . . . . 1.05 110.604 176.038 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -71.45 -33.61 69.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.416 -0.811 . . . . 1.22 110.831 -177.027 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.711 ' HE2' ' HA ' ' A' ' 16' ' ' LYS . 9.9 mmpt? -76.54 -27.87 56.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.509 -0.314 . . . . 1.41 111.593 -177.885 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.597 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -73.55 -29.51 62.49 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 120.103 -0.639 . . . . 1.35 109.871 174.512 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.3 t -65.57 -28.83 69.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.79 -0.641 . . . . 0.94 111.526 -176.346 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 28.5 pt20 -79.14 -5.88 55.21 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.433 0.635 . . . . 1.37 110.86 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.488 ' HD2' ' HG3' ' A' ' 19' ' ' GLN . 18.6 mmmt -108.77 -25.17 10.95 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 122.148 0.975 . . . . 2.2 108.946 -179.419 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.81 25.78 7.88 Favored Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 113.605 -1.634 . . . . 0.53 111.227 179.136 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -120.33 166.74 13.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.315 -0.442 . . . . 0.76 110.669 177.735 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.503 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 4.6 t -112.35 149.8 31.96 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.071 -0.513 . . . . 0.52 110.327 178.25 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.423 ' CE2' HG13 ' A' ' 10' ' ' VAL . 2.8 t90 -67.63 -50.65 56.99 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.031 0.443 . . . . 3.36 109.963 172.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.511 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 3.8 p -64.08 -31.65 72.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.559 -0.746 . . . . 1.37 111.738 -171.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.503 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 95.0 mt-30 -56.4 -27.42 56.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.924 0.392 . . . . 1.11 111.371 178.046 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -120.61 11.33 11.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.26 -0.427 . . . . 1.28 111.382 -175.388 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.604 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 59.0 p -98.02 -178.05 3.95 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.784 0.661 . . . . 1.81 112.784 -170.023 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.53 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 11.1 t70 -170.66 -26.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 114.649 -1.16 . . . . 2.31 109.441 -177.408 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.896 HG23 ' H ' ' A' ' 31' ' ' GLU . 6.6 m -47.43 -72.21 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-N 114.586 -1.188 . . . . 0.92 112.866 -174.077 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.896 ' H ' HG23 ' A' ' 30' ' ' VAL . 7.9 pt-20 -102.48 1.17 34.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.483 0.659 . . . . 2.74 109.386 175.429 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.53 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 15.5 tt0 . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 115.017 -0.992 . . . . 1.45 111.435 -179.382 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.862 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.8 t . . . . . 0 CA--C 1.538 0.497 0 N-CA-C 109.29 -0.633 . . . . 1.12 109.29 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.862 ' H ' HG23 ' A' ' 41' ' ' THR . 13.7 pt-20 -93.28 -29.87 15.45 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 122.66 1.219 . . . . 2.02 108.418 164.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.716 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 6.7 p -60.42 -23.35 64.31 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 112.595 -2.093 . . . . 1.25 113.77 -170.241 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -55.91 -46.02 78.54 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.124 -0.63 . . . . 1.91 109.9 179.167 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.511 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -76.57 -34.94 58.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.071 0.462 . . . . 0.52 110.35 177.04 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.716 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 88.1 t -61.06 -61.08 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.514 -0.766 . . . . 1.41 111.302 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.1 ptpt -59.91 -34.74 73.6 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.088 -0.708 . . . . 0.67 109.088 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.636 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 28.8 mm-40 -64.79 -41.49 95.8 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.729 -0.669 . . . . 0.99 110.393 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.779 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -67.71 -36.38 80.51 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.336 0.589 . . . . 0.42 110.392 175.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.2 mp -72.41 -24.14 61.19 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.411 -0.813 . . . . 1.33 111.524 -178.255 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.636 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -81.31 -18.48 45.63 Favored 'General case' 0 CA--C 1.509 -0.613 0 C-N-CA 119.453 -0.899 . . . . 2.17 109.027 178.0 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.477 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 4.3 mm-40 -80.46 -54.38 5.74 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.597 -1.183 . . . . 1.1 109.983 175.302 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.83 -41.11 99.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.38 -0.827 . . . . 0.53 109.907 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.685 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -64.04 -43.61 97.08 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.299 -0.864 . . . . 0.7 111.413 175.465 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 51' ' ' ARG . 19.1 t70 -52.85 -50.11 64.42 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.432 0.293 . . . . 1.04 110.964 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.736 ' O ' ' HG2' ' A' ' 60' ' ' ARG . 41.4 mt-10 -65.32 -28.22 69.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.138 -0.483 . . . . 2.29 110.955 179.419 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.514 ' HE2' ' HB2' ' A' ' 102' ' ' ALA . 0.3 OUTLIER -81.09 -19.86 42.75 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.388 -0.369 . . . . 2.29 111.983 177.732 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.685 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 92.1 mt-10 -62.57 -57.07 12.44 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 122.516 -0.115 . . . . 1.3 111.15 -178.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.866 HD13 ' H ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -62.99 -31.96 73.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.727 -0.215 . . . . 1.54 111.255 179.191 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.736 ' HG2' ' O ' ' A' ' 56' ' ' GLU . 18.7 mmt180 -50.2 -52.03 39.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.231 -0.441 . . . . 2.58 110.8 173.836 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.476 ' HB2' ' CZ ' ' A' ' 65' ' ' PHE . 28.9 m-85 -92.47 -3.83 54.57 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.206 -0.452 . . . . 5.32 111.827 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.797 ' HB2' ' HA ' ' A' ' 59' ' ' LEU . 21.7 tpp180 -50.43 -50.81 51.04 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.577 0.584 . . . . 4.48 112.577 -171.058 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -71.41 -16.29 62.39 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.191 0.519 . . . . 4.72 111.084 -177.362 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.499 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -90.2 -38.98 13.09 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.498 0.555 . . . . 1.17 112.498 -172.436 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.476 ' CZ ' ' HB2' ' A' ' 61' ' ' TYR . 44.8 m-85 -45.56 -46.46 14.16 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.247 0.832 . . . . 2.81 113.247 -170.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.9 t -66.27 -27.14 67.71 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.086 0.47 . . . . 2.19 111.215 -174.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -88.56 -34.49 17.34 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.497 0.665 . . . . 2.72 109.502 176.234 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.709 ' O ' HD12 ' A' ' 72' ' ' LEU . 5.5 mp -66.45 -31.37 72.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.139 -0.937 . . . . 1.56 112.595 -176.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.71 HG22 HG13 ' A' ' 74' ' ' ILE . 11.7 p -61.17 -24.23 66.16 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.109 -0.636 . . . . 0.7 110.661 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.1 t -77.65 -41.02 39.75 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.824 -0.625 . . . . 1.34 109.391 172.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.609 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 44.1 mt-30 -61.03 -49.48 77.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.369 -0.832 . . . . 1.42 110.588 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.73 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.2 mp -75.53 -31.33 60.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.63 -0.713 . . . . 1.37 110.603 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 48.0 m80 65.92 59.69 0.7 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.64 0.733 . . . . 2.72 109.131 -172.028 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.71 HG13 HG22 ' A' ' 69' ' ' THR . 23.6 mm -59.29 112.79 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.4 -1.273 . . . . 0.91 111.382 -178.749 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.741 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -153.07 -171.97 0.3 Allowed Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 107.781 -1.192 . . . . 0.51 107.781 -170.029 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.741 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 21.7 Cg_exo -30.25 166.2 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 124.911 3.74 . . . . 0.47 114.935 165.784 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.498 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -29.59 -30.23 0.01 OUTLIER Glycine 0 N--CA 1.472 1.058 0 N-CA-C 117.282 1.673 . . . . 0.4 117.282 -172.085 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.457 ' N ' ' O ' ' A' ' 76' ' ' PRO . 32.2 p -67.87 6.12 0.75 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 118.019 0.909 . . . . 0.56 112.157 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.57 -12.92 61.87 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.962 0.411 . . . . 0.34 109.982 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.498 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 5.0 p90 -78.26 -16.34 57.89 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.15 0.5 . . . . 4.13 109.68 175.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.534 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 32.3 mt-30 -84.78 -24.51 28.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.775 0.798 . . . . 1.03 109.604 171.419 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.73 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 13.0 m -73.46 -52.1 14.84 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 114.566 -1.197 . . . . 0.48 109.361 172.221 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.564 ' HA ' HG23 ' A' ' 86' ' ' VAL . 86.9 t80 -67.14 -17.02 64.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.183 -0.917 . . . . 1.18 109.908 175.143 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.635 ' HA ' HG12 ' A' ' 87' ' ' VAL . 43.0 tt0 -58.54 -48.86 79.47 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.033 -0.531 . . . . 0.8 110.195 174.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -47.14 -35.45 7.24 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.176 -0.92 . . . . 1.62 110.917 174.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.76 HG13 ' HG ' ' B' 1008 ' ' LEU . 1.7 t -82.14 -49.91 16.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 114.534 -1.212 . . . . 1.3 110.503 -175.708 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.635 HG12 ' HA ' ' A' ' 84' ' ' GLU . 8.4 p -62.8 -21.35 27.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 O-C-N 121.494 -0.754 . . . . 0.85 109.991 179.093 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.489 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 3.0 m-80 -78.44 -37.34 43.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.373 -1.285 . . . . 0.91 112.475 177.505 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 1.104 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.3 pp20? -73.38 -29.27 62.52 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 108.904 -0.776 . . . . 2.87 108.904 175.711 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.759 ' HB3' ' NH1' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -72.72 -35.82 67.65 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-N 114.549 -1.205 . . . . 1.28 111.401 -168.087 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.489 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -103.87 12.91 33.85 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.136 0.493 . . . . 2.3 110.918 -173.168 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.903 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -51.91 -43.12 63.26 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.404 -0.816 . . . . 5.06 112.09 -178.318 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.591 ' H ' ' HD3' ' A' ' 92' ' ' ARG . 14.7 t70 -74.0 -23.12 59.39 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 122.066 0.936 . . . . 3.12 110.371 177.113 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.853 ' O ' HG23 ' A' ' 95' ' ' VAL . . . 131.03 -38.7 1.89 Allowed Glycine 0 N--CA 1.436 -1.307 0 CA-C-N 114.037 -1.438 . . . . 2.31 110.245 177.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.853 HG23 ' O ' ' A' ' 94' ' ' GLY . 2.7 t 172.88 135.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.347 0.488 0 C-N-CA 126.96 2.104 . . . . 1.06 108.388 160.075 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.831 ' H ' ' HG2' ' A' ' 99' ' ' ARG . 8.6 m-20 -111.35 147.14 35.79 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.431 -0.581 . . . . 2.12 109.431 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.563 ' HA ' ' CE3' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -54.51 -46.49 73.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.188 0.518 . . . . 3.34 110.581 177.437 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.445 ' HA2' HG13 ' A' ' 101' ' ' VAL . . . -79.32 -19.57 71.49 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.925 -0.655 . . . . 0.69 112.872 -178.412 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.831 ' HG2' ' H ' ' A' ' 96' ' ' ASN . 0.1 OUTLIER -72.45 -28.74 63.13 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.73 -0.47 . . . . 4.24 109.73 -179.354 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 77.5 mt -65.27 -38.52 82.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.76 -0.459 . . . . 0.44 109.76 177.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.464 ' HA ' ' CD1' ' A' ' 104' ' ' PHE . 2.0 m -69.66 -34.69 62.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 116.134 -0.484 . . . . 1.35 109.93 175.218 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.514 ' HB2' ' HE2' ' A' ' 57' ' ' PHE . . . -63.23 -49.34 74.52 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.558 0.694 . . . . 0.44 110.078 175.696 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -55.13 -49.11 72.59 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.313 -1.312 . . . . 1.49 111.715 -179.322 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.587 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 0.2 OUTLIER -77.27 -26.59 52.57 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.489 -0.484 . . . . 3.29 110.832 -176.336 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.696 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 29.2 t -73.55 -49.42 26.53 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.109 0.48 . . . . 1.19 110.197 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.495 ' HZ ' HD11 ' A' ' 72' ' ' LEU . 29.2 t80 -71.2 -24.89 62.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.893 -0.594 . . . . 2.89 109.802 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.403 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -68.19 -43.25 81.1 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.804 -0.712 . . . . 0.3 111.334 172.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.834 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.61 -32.41 84.08 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.77 -0.729 . . . . 0.23 111.319 174.862 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.58 -30.02 61.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.827 0.346 . . . . 0.31 110.639 175.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.548 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.8 -41.18 97.96 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 107.988 -1.116 . . . . 1.12 107.988 -179.634 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.691 ' SG ' HG22 ' A' ' 123' ' ' VAL . 25.0 t -52.58 -54.55 31.47 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.468 -1.696 . . . . 0.26 110.904 173.263 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.405 HG11 ' HD3' ' A' ' 20' ' ' LYS . 68.9 t -64.37 -41.25 91.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 0.35 111.588 -177.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.51 ' HB3' HG21 ' A' ' 74' ' ' ILE . 1.4 mm-40 -60.62 -25.03 65.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.035 0.445 . . . . 2.51 110.746 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.454 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 50.6 m -77.14 -40.59 45.05 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 108.896 -0.779 . . . . 0.28 108.896 174.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 111' ' ' CYS . 98.2 t -64.47 -35.42 74.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.095 -0.957 . . . . 1.23 109.461 -179.613 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -50.17 -50.89 47.67 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 113.582 -1.645 . . . . 0.6 111.129 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.406 ' HB2' ' HG3' ' A' ' 119' ' ' MET . 12.8 mmtp -87.2 14.1 8.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.703 -0.68 . . . . 1.62 110.621 -179.188 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 66.1 38.34 4.8 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.443 0.639 . . . . 1.88 110.308 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.465 ' HB3' HD23 ' A' ' 122' ' ' LEU . 24.7 mtm -117.71 50.16 1.16 Allowed 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.551 -0.907 . . . . 0.31 108.551 -178.502 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.417 ' HA ' HG23 ' A' ' 123' ' ' VAL . 0.8 OUTLIER -65.63 -7.1 13.35 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.725 -1.125 . . . . 1.15 112.285 -176.116 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.531 HG23 HD22 ' A' ' 122' ' ' LEU . 30.0 m -68.04 -20.54 25.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.616 0.246 . . . . 0.46 111.349 173.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.724 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -76.39 -27.18 56.25 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 110.216 -0.29 . . . . 0.26 110.216 177.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.691 HG22 ' SG ' ' A' ' 111' ' ' CYS . 56.3 t -44.69 -53.15 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 O-C-N 123.986 0.804 . . . . 0.25 112.162 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.604 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 1.5 p -69.93 -39.42 76.14 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-O 120.86 0.362 . . . . 1.35 111.587 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.724 ' HD2' HD13 ' A' ' 122' ' ' LEU . 92.2 mtt180 -62.15 -55.5 28.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.571 -0.74 . . . . 2.67 110.183 -177.252 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.622 ' HA ' ' CE2' ' A' ' 129' ' ' TRP . 77.9 mt -51.93 -51.14 30.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.512 -0.767 . . . . 0.23 111.177 -179.645 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.66 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.81 -25.57 63.29 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.804 0.298 . . . . 0.29 111.804 -178.608 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.965 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -67.35 -63.88 0.97 Allowed 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.131 0.491 . . . . 0.28 110.089 -178.34 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' TRP . . . . . 0.622 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 24.1 p-90 -78.1 -16.72 57.74 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 115.304 -0.862 . . . . 3.91 112.059 -174.534 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.607 ' SD ' HG22 ' A' ' 126' ' ' ILE . 81.7 mtp -59.39 -54.35 47.77 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.144 -0.622 . . . . 1.08 109.822 169.698 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.47 -38.29 77.67 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.763 -0.653 . . . . 0.25 110.689 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.606 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 56.7 m -60.92 -43.34 98.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 121.062 -0.255 . . . . 0.4 111.378 175.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.477 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 82.7 t80 -59.71 -43.09 94.28 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.963 -0.384 . . . . 3.13 109.963 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.717 HD13 ' HB2' ' A' ' 5' ' ' ASN . 5.4 tt -60.62 -47.62 85.42 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.734 -0.839 . . . . 0.95 108.734 174.737 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 135' ' ' ASN . . . . . 0.425 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 1.9 m120 -48.37 -58.59 4.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.663 -0.699 . . . . 0.46 112.394 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -81.39 -45.56 15.92 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.197 0.443 . . . . 0.59 112.197 -173.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' HIS . . . . . 0.477 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 1.6 m-70 -90.64 -50.14 6.09 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.744 0.646 . . . . 1.45 112.744 -170.751 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.62 HD21 ' NH2' ' A' ' 99' ' ' ARG . 59.9 mt -89.33 -39.03 13.72 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 113.44 0.904 . . . . 1.2 113.44 -165.554 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.648 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 32.1 tt0 -50.81 -52.45 57.01 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-O 119.134 -0.46 . . . . 0.75 112.098 -172.687 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.637 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.1 Cg_exo -53.85 -51.71 10.11 Favored 'Trans proline' 0 C--N 1.358 1.049 0 C-N-CA 121.772 1.648 . . . . 0.56 111.505 176.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 141' ' ' TRP . . . . . 0.505 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 8.4 t-105 -55.14 -51.9 64.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.186 -0.915 . . . . 1.2 110.678 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.602 HD12 ' HA ' ' A' ' 139' ' ' GLU . 59.7 mt -46.85 -53.06 3.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.884 -0.598 . . . . 0.32 111.654 172.645 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.648 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 76.3 mm-40 -62.18 -29.87 70.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.085 -0.507 . . . . 0.57 111.675 -178.235 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.637 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 11.6 mm-40 -63.95 -20.57 65.97 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.611 0.72 . . . . 0.78 110.437 175.015 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -104.1 0.94 30.28 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.072 -0.967 . . . . 0.93 109.019 -175.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 124.8 -46.24 1.1 Allowed Glycine 0 N--CA 1.441 -1.028 0 CA-C-N 114.85 -1.068 . . . . 0.56 112.299 178.094 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' GLY . . . . . 0.429 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 135.03 178.21 15.51 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.238 -0.745 . . . . 0.49 111.238 -177.492 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.688 ' HB2' ' OE1' ' A' ' 42' ' ' GLU . 5.2 m-90 -63.5 -37.66 88.17 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 117.056 0.428 . . . . 3.57 110.412 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 20.7 m-20 -52.85 -43.9 66.39 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.211 0.529 . . . . 1.96 110.203 176.243 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.574 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 89.2 m -60.24 -37.82 81.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.211 -0.904 . . . . 0.67 111.95 -175.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.438 ' CE2' HD12 ' A' ' 50' ' ' LEU . 84.7 t80 -62.97 -38.46 91.19 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.402 -0.519 . . . . 3.0 109.989 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.643 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.5 m -74.67 -24.57 18.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.222 0.534 . . . . 1.15 109.774 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 36.2 mm-40 -64.35 -25.49 68.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.201 0.524 . . . . 1.67 110.081 173.042 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.0 mt -96.03 -57.42 2.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.697 -0.683 . . . . 1.3 110.476 178.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -120.36 28.82 7.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.561 -0.745 . . . . 4.24 111.279 -170.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.779 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -60.94 167.69 10.84 Favored Glycine 0 CA--C 1.501 -0.817 0 CA-C-N 115.576 -0.738 . . . . 1.1 113.258 179.257 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.557 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 11.3 t30 . . . . . 0 C--N 1.31 -1.145 0 CA-C-N 113.994 -1.103 . . . . 1.29 111.49 -178.265 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1005 ' ' GLY . . . . . 0.943 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.529 0.918 0 N-CA-C 113.416 0.126 . . . . 1.2 113.416 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -83.3 -56.86 3.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.003 0.43 . . . . 2.88 111.133 174.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -67.83 -54.98 14.74 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.895 0.702 . . . . 1.31 112.895 -169.677 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.76 ' HG ' HG13 ' A' ' 86' ' ' VAL . 3.0 mm? -58.44 -53.64 56.01 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.227 0.329 . . . . 1.33 110.965 -175.378 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B 1009 ' ' ALA . . . . . 1.104 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -47.65 -45.74 28.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.701 0.762 . . . . 0.88 110.848 176.791 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -67.12 -54.45 21.23 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.303 -1.317 . . . . 1.03 111.406 -177.086 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -66.71 -17.1 64.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.516 . . . . 1.67 110.528 179.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -83.94 -3.99 88.85 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.863 -0.608 . . . . 0.78 113.467 -176.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -93.56 3.9 54.8 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.645 0.736 . . . . 1.9 109.796 176.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 34.4 m . . . . . 0 C--N 1.327 -0.381 0 CA-C-N 115.668 -0.696 . . . . 1.44 111.687 -175.263 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 . . . . . 0 C--O 1.233 0.188 0 CA-C-O 121.682 0.753 . . . . 2.42 109.546 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.446 ' CB ' ' HG2' ' A' ' 42' ' ' GLU . 0.9 OUTLIER -72.78 -3.97 28.65 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.097 -0.956 . . . . 1.25 110.852 -178.427 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.554 ' HB2' ' HG ' ' A' ' 134' ' ' LEU . 3.3 p30 -62.97 -26.66 68.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.986 -0.552 . . . . 1.78 111.218 177.418 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.829 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.9 tpp180 -51.52 -49.87 61.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.05 -0.523 . . . . 1.4 110.506 173.692 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.813 ' HB3' ' HE3' ' A' ' 47' ' ' LYS . 53.1 mt-10 -50.49 -52.74 35.56 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.964 -1.017 . . . . 0.68 112.066 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.65 HD11 HG22 ' A' ' 46' ' ' VAL . 1.2 mp -50.71 -31.47 16.59 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.913 0.885 . . . . 1.16 112.094 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.482 HG13 ' HE2' ' A' ' 130' ' ' MET . 96.3 t -80.35 -60.35 2.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-O 121.48 0.657 . . . . 0.27 110.023 174.277 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 6' ' ' ARG . 46.4 t -53.37 -54.2 19.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 114.79 -1.095 . . . . 0.33 112.755 -174.205 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -57.25 -36.53 71.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.128 0.489 . . . . 0.59 110.316 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.704 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -66.31 -53.54 35.33 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.633 -0.712 . . . . 1.61 109.985 179.246 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 1.015 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.7 mp -60.68 -38.5 85.15 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 120.699 0.285 . . . . 0.34 110.827 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.515 ' HA ' ' CB ' ' A' ' 24' ' ' TRP . 27.0 t -60.67 -37.05 80.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.17 0.51 . . . . 1.05 110.677 177.833 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -77.07 -23.81 51.92 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.975 -0.557 . . . . 1.22 110.252 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.795 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 8.8 mmpt? -81.67 -39.94 23.6 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.281 -0.418 . . . . 1.41 111.648 -177.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.593 HD23 ' HA ' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -61.99 -27.84 69.15 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 119.926 -0.709 . . . . 1.35 110.183 176.294 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.7 t -75.04 -13.9 60.54 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.526 -0.761 . . . . 0.94 111.337 -177.517 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.795 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 20.7 pt20 -81.01 -9.39 59.85 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.388 0.613 . . . . 1.37 111.883 -177.28 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.802 ' HZ3' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -120.02 -20.3 7.52 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 122.048 0.928 . . . . 2.2 109.646 178.828 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.65 29.98 5.4 Favored Glycine 0 C--N 1.305 -1.18 0 CA-C-N 113.869 -1.514 . . . . 0.53 112.799 175.422 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -109.82 169.69 8.55 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.715 0.293 . . . . 0.76 110.909 168.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.5 t -105.27 150.19 25.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.153 0.501 . . . . 0.52 110.843 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.593 ' HA ' HD23 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -81.11 -43.79 18.91 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.346 -0.843 . . . . 3.36 110.032 172.88 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.452 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 7.0 p -71.21 -23.51 62.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.971 -0.559 . . . . 1.37 111.564 -172.167 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -65.15 -27.26 68.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.902 0.382 . . . . 1.11 110.966 175.126 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -122.28 16.56 10.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.05 -0.523 . . . . 1.28 112.21 -174.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.452 ' OG ' ' HA ' ' A' ' 25' ' ' SER . 90.2 p -100.61 -179.23 4.03 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.88 0.696 . . . . 1.81 112.88 -172.822 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.544 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.9 t70 -168.59 -24.19 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.324 -1.307 . . . . 2.31 109.806 178.716 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.832 HG23 ' H ' ' A' ' 31' ' ' GLU . 9.2 m -47.48 -70.95 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 114.912 -1.04 . . . . 0.92 113.08 -171.646 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.832 ' H ' HG23 ' A' ' 30' ' ' VAL . 9.3 pt-20 -100.82 2.43 41.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.721 0.772 . . . . 2.74 109.054 175.416 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.544 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 29.5 tt0 . . . . . 0 N--CA 1.448 -0.534 0 CA-C-N 114.624 -1.171 . . . . 1.45 111.127 -177.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.802 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.5 t . . . . . 0 CA--C 1.54 0.575 0 N-CA-C 111.482 0.178 . . . . 1.12 111.482 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.802 ' H ' HG23 ' A' ' 41' ' ' THR . 11.9 pt-20 -94.56 -30.58 14.3 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-O 122.152 0.977 . . . . 2.02 110.376 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.932 ' HA ' HG13 ' A' ' 46' ' ' VAL . 58.5 m -75.66 -17.85 59.84 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.725 -1.58 . . . . 1.25 114.372 -166.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.583 ' HA ' ' CD ' ' A' ' 47' ' ' LYS . 39.4 tt0 -45.68 -47.02 15.09 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 118.237 0.471 . . . . 1.91 111.113 -177.316 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.64 -46.03 64.06 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.721 0.267 . . . . 0.52 111.721 175.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.932 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.9 m -67.1 -35.47 74.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 120.946 0.403 . . . . 1.41 111.309 -175.862 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.813 ' HE3' ' HB3' ' A' ' 7' ' ' GLU . 6.8 ptmt -77.66 -32.29 53.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.963 -0.754 . . . . 0.67 108.963 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.611 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 5.6 mm-40 -66.08 -30.47 70.99 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.719 -0.673 . . . . 0.99 110.131 173.512 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.641 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -76.95 -42.66 38.3 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.233 0.54 . . . . 0.42 111.077 176.638 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.561 HD21 ' HD2' ' A' ' 104' ' ' PHE . 1.3 tp -66.29 -25.1 66.7 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.621 -0.718 . . . . 1.33 112.486 -173.125 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.579 ' HD2' ' OE1' ' A' ' 48' ' ' GLN . 8.9 ptp180 -81.33 -28.42 34.55 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 109.069 -0.715 . . . . 2.17 109.069 -175.597 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 10.8 mm-40 -74.2 -49.17 24.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.546 -1.206 . . . . 1.1 109.38 176.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.65 -39.35 88.01 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.483 -0.78 . . . . 0.53 110.092 174.586 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.67 ' HA3' ' HZ ' ' A' ' 12' ' ' PHE . . . -63.91 -43.88 96.87 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.59 -0.732 . . . . 0.7 112.047 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.615 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 32.6 t70 -58.14 -43.74 87.47 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.691 0.281 . . . . 1.04 110.256 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 52' ' ' GLU . 78.0 mm-40 -58.19 -28.3 64.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.687 -0.688 . . . . 2.29 111.381 177.532 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -81.69 -44.54 16.98 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.919 -0.582 . . . . 2.29 110.83 176.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.654 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 37.4 mt-10 -61.96 -63.2 1.33 Allowed 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.833 -0.621 . . . . 1.3 112.007 -172.415 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.713 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -48.9 -34.25 12.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.999 0.74 . . . . 1.54 112.999 -173.738 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.713 ' H ' HD12 ' A' ' 59' ' ' LEU . 71.5 mtt-85 -62.88 -61.6 2.29 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.109 0.481 . . . . 2.58 111.45 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -92.05 -3.61 55.55 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.827 -0.624 . . . . 5.32 112.073 -173.078 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -49.93 -29.58 8.62 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 113.047 0.758 . . . . 4.48 113.047 -175.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.9 mtp180 -54.32 -34.08 60.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.799 0.333 . . . . 4.72 111.741 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.641 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -88.72 -26.6 21.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.491 -0.322 . . . . 1.17 111.418 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.605 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 39.0 t80 -46.83 -45.99 20.52 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.557 0.577 . . . . 2.81 112.557 -173.655 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.4 p -69.0 -24.92 64.28 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.848 0.356 . . . . 2.19 111.629 -175.057 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -90.57 -29.77 17.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.482 -0.326 . . . . 2.72 111.182 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.665 ' O ' HD12 ' A' ' 72' ' ' LEU . 18.8 mt -61.55 -22.77 65.46 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 112.589 0.589 . . . . 1.56 112.589 -173.293 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.624 HG22 HG13 ' A' ' 74' ' ' ILE . 15.8 p -58.68 -23.31 59.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 0.7 110.956 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 7.6 t -77.66 -38.99 46.49 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.903 -0.59 . . . . 1.34 109.64 176.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.46 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 46.1 mt-30 -65.15 -54.45 29.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.691 -0.686 . . . . 1.42 109.837 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.665 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.2 mp -66.36 -30.48 70.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.452 -0.794 . . . . 1.37 110.129 179.256 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 63.71 59.83 1.13 Allowed 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 122.167 0.984 . . . . 2.72 108.474 -175.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.624 HG13 HG22 ' A' ' 69' ' ' THR . 17.2 mm -57.82 122.96 8.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 113.789 -1.55 . . . . 0.91 111.01 -178.843 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.749 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -157.34 -172.82 0.34 Allowed Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 108.021 -1.104 . . . . 0.51 108.021 -168.825 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.749 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 34.9 Cg_exo -29.63 165.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 125.119 3.879 . . . . 0.47 115.266 165.658 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.435 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.56 -29.9 0.01 OUTLIER Glycine 0 N--CA 1.473 1.151 0 N-CA-C 117.33 1.692 . . . . 0.4 117.33 -174.034 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 76' ' ' PRO . 39.4 p -71.66 11.08 0.54 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 117.79 0.795 . . . . 0.56 111.938 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.01 -13.17 61.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.246 0.546 . . . . 0.34 109.736 172.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -78.79 -14.57 59.19 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.173 -0.677 . . . . 4.13 109.173 175.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.433 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 53.5 mt-30 -84.52 -20.87 30.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.828 0.823 . . . . 1.03 109.917 172.612 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.595 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 6.5 m -80.02 -48.64 12.99 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 114.575 -1.193 . . . . 0.48 108.828 169.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -62.75 -17.43 60.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.887 -1.051 . . . . 1.18 109.915 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.645 ' HA ' HG12 ' A' ' 87' ' ' VAL . 34.7 tt0 -60.49 -50.44 73.53 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.458 -0.792 . . . . 0.8 110.579 177.437 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -47.47 -35.14 8.22 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.01 -0.995 . . . . 1.62 110.702 176.255 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.643 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.6 t -81.83 -51.38 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.978 0 CA-C-N 114.485 -1.234 . . . . 1.3 110.7 -177.111 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.645 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.8 p -61.58 -23.9 32.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-O 121.554 0.692 . . . . 0.85 109.731 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.427 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 1.8 m-80 -71.99 -40.74 68.34 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.402 -1.272 . . . . 0.91 111.977 176.433 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 1.03 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.3 pp20? -73.23 -29.43 62.78 Favored 'General case' 0 CA--C 1.495 -1.149 0 CA-C-O 121.699 0.761 . . . . 2.87 109.127 177.104 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.691 ' HG ' ' HD3' ' A' ' 99' ' ' ARG . 0.1 OUTLIER -71.05 -32.52 69.27 Favored 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.556 -1.202 . . . . 1.28 111.619 -168.158 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.427 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 2.3 p90 -107.47 11.69 28.59 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.108 0.48 . . . . 2.3 110.859 -172.419 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.911 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -54.42 -34.53 61.53 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.685 -0.689 . . . . 5.06 112.553 -177.789 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.649 ' HB3' ' OD1' ' A' ' 96' ' ' ASN . 15.4 t70 -84.48 -18.76 34.8 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 122.101 0.953 . . . . 3.12 110.239 176.787 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.866 ' O ' HG23 ' A' ' 95' ' ' VAL . . . 130.95 -40.0 1.71 Allowed Glycine 0 N--CA 1.44 -1.037 0 CA-C-N 114.234 -1.348 . . . . 2.31 110.918 173.901 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.866 HG23 ' O ' ' A' ' 94' ' ' GLY . 2.9 t 173.36 110.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.349 0.566 0 C-N-CA 127.022 2.129 . . . . 1.06 108.15 160.531 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.805 ' HB2' ' HB3' ' A' ' 99' ' ' ARG . 2.1 m-20 -83.91 152.83 24.3 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.753 -0.462 . . . . 2.12 109.753 -177.023 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.54 ' HH2' ' HB2' ' A' ' 155' ' ' TYR . 84.9 t90 -59.04 -52.84 64.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.272 0.558 . . . . 3.34 110.111 178.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.436 ' HA2' HG13 ' A' ' 101' ' ' VAL . . . -77.41 -16.34 80.5 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.646 -0.706 . . . . 0.69 112.698 -177.45 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.805 ' HB3' ' HB2' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -72.51 -29.26 63.45 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.535 -0.542 . . . . 4.24 109.535 -179.635 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 33.0 mt -63.3 -45.11 99.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 109.394 -0.595 . . . . 0.44 109.394 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.436 HG13 ' HA2' ' A' ' 98' ' ' GLY . 1.8 m -62.6 -39.33 84.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.827 -0.624 . . . . 1.35 109.648 175.646 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.24 -44.86 94.02 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 121.087 0.47 . . . . 0.44 111.04 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -58.66 -42.06 87.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.289 -0.869 . . . . 1.49 110.956 -179.213 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.651 ' HZ ' ' HB2' ' A' ' 134' ' ' LEU . 28.9 m-85 -80.63 -30.18 36.71 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.671 0.272 . . . . 3.29 111.145 179.229 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.59 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 48.0 t -63.65 -56.23 17.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.153 -0.476 . . . . 1.19 110.222 176.003 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.448 ' HA ' ' HB3' ' A' ' 109' ' ' ALA . 32.7 t80 -74.31 -26.34 60.11 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.928 -0.578 . . . . 2.89 110.364 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.99 -45.59 86.68 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.336 -0.935 . . . . 0.3 111.016 173.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 1.015 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.5 -29.42 74.78 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 111.11 -0.796 . . . . 0.23 111.11 174.399 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.605 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -71.51 -34.54 70.19 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.983 -0.377 . . . . 0.31 109.983 176.643 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.486 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.3 OUTLIER -67.55 -34.88 77.97 Favored 'General case' 0 CA--C 1.506 -0.741 0 CA-C-O 121.892 0.853 . . . . 1.12 109.781 -179.267 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.698 ' SG ' HG13 ' A' ' 123' ' ' VAL . 44.2 t -51.25 -50.73 58.65 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.295 -1.321 . . . . 0.26 109.271 170.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.802 HG13 ' HZ3' ' A' ' 20' ' ' LYS . 86.3 t -63.84 -38.19 81.69 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 CA-C-N 116.252 -0.431 . . . . 0.35 110.514 175.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.489 ' HB3' HG13 ' A' ' 74' ' ' ILE . 42.8 mt-10 -56.12 -33.19 64.91 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.977 0.418 . . . . 2.51 110.552 176.168 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.461 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 25.1 m -79.73 -41.65 26.24 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.006 -0.543 . . . . 0.28 109.557 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 111' ' ' CYS . 99.3 t -68.74 -31.01 49.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.827 0.822 . . . . 1.23 109.739 -175.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -55.61 -47.9 75.8 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.015 -1.448 . . . . 0.6 110.858 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 23.8 mmtt -90.2 14.42 12.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.678 -0.692 . . . . 1.62 110.325 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 62.25 43.78 8.16 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.74 0.781 . . . . 1.88 111.278 -179.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.465 ' HB3' HD23 ' A' ' 122' ' ' LEU . 32.8 mtm -115.96 49.33 1.12 Allowed 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.645 -1.242 . . . . 0.31 107.645 178.616 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.432 ' CD ' ' H ' ' A' ' 120' ' ' GLN . 6.4 mp0 -67.85 -6.72 22.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.182 -1.372 . . . . 1.15 112.455 -171.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.469 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 27.0 m -72.52 -12.79 16.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.935 0.398 . . . . 0.46 111.211 175.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.71 HD13 ' HD3' ' A' ' 125' ' ' ARG . 2.9 mm? -83.62 -24.09 31.58 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 109.776 -0.453 . . . . 0.26 109.776 176.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.698 HG13 ' SG ' ' A' ' 111' ' ' CYS . 67.4 t -46.9 -55.58 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.783 -0.644 . . . . 0.25 112.223 -178.31 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 12.8 t -73.88 -31.41 63.13 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.729 -0.388 . . . . 1.35 110.142 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.71 ' HD3' HD13 ' A' ' 122' ' ' LEU . 11.8 mtp180 -61.23 -58.66 7.37 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 120.859 0.362 . . . . 2.67 110.639 178.833 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.661 HG22 ' SD ' ' A' ' 130' ' ' MET . 71.2 mt -51.77 -52.62 21.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.545 -0.752 . . . . 0.23 110.043 179.257 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.802 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.19 -36.31 68.23 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.945 0.402 . . . . 0.29 111.627 179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.829 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -63.59 -59.64 4.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.219 0.533 . . . . 0.28 110.499 176.749 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 68.7 m95 -67.36 -22.74 65.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.887 -1.051 . . . . 3.91 111.504 -174.296 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.661 ' SD ' HG22 ' A' ' 126' ' ' ILE . 85.9 mtp -69.24 -54.11 16.44 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.679 0.276 . . . . 1.08 111.244 175.068 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.456 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -67.11 -33.17 74.89 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.506 -0.316 . . . . 0.25 110.844 -177.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 97.6 m -63.8 -45.14 91.04 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.672 -0.411 . . . . 0.4 110.884 175.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -57.91 -41.97 83.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.034 0.445 . . . . 3.13 110.04 176.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.94 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.5 OUTLIER -57.38 -58.11 9.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.728 -0.669 . . . . 0.95 109.663 172.242 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -45.22 -55.28 5.98 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.036 -0.984 . . . . 0.46 112.631 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -76.21 -53.33 8.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.994 0.426 . . . . 0.59 111.853 -173.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.79 -50.27 5.83 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.774 0.657 . . . . 1.45 112.774 -169.241 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.94 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -76.55 -47.35 22.88 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 113.629 0.974 . . . . 1.2 113.629 -167.453 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.594 ' HA ' HD12 ' A' ' 142' ' ' ILE . 18.7 tt0 -45.24 -52.36 21.4 Favored Pre-proline 0 CA--C 1.538 0.511 0 O-C-N 123.965 0.791 . . . . 0.75 112.785 -170.815 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.555 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 31.3 Cg_exo -58.52 -45.21 31.52 Favored 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 121.704 1.603 . . . . 0.56 111.689 178.441 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' TRP . . . . . 0.679 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.8 OUTLIER -58.78 -52.07 67.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.174 -0.921 . . . . 1.2 110.846 179.137 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.595 HD13 ' NE1' ' A' ' 148' ' ' TRP . 59.1 mt -45.62 -52.52 2.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.661 -0.7 . . . . 0.32 111.768 175.482 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.573 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.7 mm-40 -58.32 -34.44 70.6 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.812 -0.631 . . . . 0.57 111.34 -179.401 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 10.8 mm-40 -64.03 -22.9 67.12 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.118 0.485 . . . . 0.78 111.103 177.012 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -100.9 -7.45 23.45 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.655 -0.702 . . . . 0.93 109.575 -173.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 134.99 -36.96 2.0 Allowed Glycine 0 N--CA 1.44 -1.034 0 CA-C-N 115.358 -0.837 . . . . 0.56 112.772 176.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 120.16 175.22 15.55 Favored Glycine 0 N--CA 1.449 -0.44 0 N-CA-C 111.146 -0.781 . . . . 0.49 111.146 -175.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.595 ' NE1' HD13 ' A' ' 142' ' ' ILE . 4.8 m-90 -67.48 -33.72 75.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.339 0.569 . . . . 3.57 111.319 -176.603 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.413 ' O ' ' HG3' ' A' ' 153' ' ' GLU . 9.7 m-20 -58.98 -40.06 83.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.119 0.485 . . . . 1.96 110.233 177.767 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.536 ' O ' ' HB2' ' A' ' 153' ' ' GLU . 55.3 m -55.54 -37.33 67.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.392 -0.822 . . . . 0.67 112.224 177.393 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.425 ' HA ' ' HZ2' ' A' ' 97' ' ' TRP . 10.5 m-85 -61.47 -39.84 92.36 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.459 -0.497 . . . . 3.0 110.356 -178.652 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.755 HG12 ' HA ' ' A' ' 46' ' ' VAL . 0.8 OUTLIER -75.42 -26.11 18.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.074 -0.512 . . . . 1.15 110.004 177.764 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.536 ' HB2' ' O ' ' A' ' 150' ' ' THR . 70.2 mt-10 -58.08 -30.35 66.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.243 -0.435 . . . . 1.67 110.483 171.554 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.53 HD12 ' CE2' ' A' ' 97' ' ' TRP . 3.4 mt -98.65 -56.7 2.38 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.23 -0.441 . . . . 1.3 111.023 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 155' ' ' TYR . . . . . 0.54 ' HB2' ' HH2' ' A' ' 97' ' ' TRP . 3.1 m-85 -120.59 28.47 7.96 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.174 -0.466 . . . . 4.24 111.098 -173.528 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.641 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -62.9 157.49 38.9 Favored Glycine 0 CA--C 1.498 -0.997 0 C-N-CA 120.654 -0.784 . . . . 1.1 112.699 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.611 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 4.4 t30 . . . . . 0 C--N 1.308 -1.197 0 CA-C-N 114.286 -0.957 . . . . 1.29 109.449 174.456 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1005 ' ' GLY . . . . . 1.008 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.534 1.223 0 N-CA-C 113.588 0.195 . . . . 1.2 113.588 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -86.23 -52.32 5.72 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.462 -0.434 . . . . 2.88 111.344 171.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -71.38 -55.02 8.79 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 113.012 0.745 . . . . 1.31 113.012 -170.017 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.57 ' HG ' HG13 ' A' ' 86' ' ' VAL . 3.3 mm? -59.75 -56.52 20.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.584 -0.28 . . . . 1.33 110.679 -177.484 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B 1009 ' ' ALA . . . . . 1.03 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -41.18 -48.83 3.51 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.899 0.749 . . . . 0.88 111.578 173.591 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -65.19 -55.22 19.82 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 114.427 -1.26 . . . . 1.03 111.786 -177.022 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -66.05 -24.92 66.83 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.024 0.44 . . . . 1.67 110.945 -178.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.44 -5.27 72.17 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.807 -0.633 . . . . 0.78 113.07 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 21.7 t70 -80.3 -20.73 43.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.264 0.554 . . . . 1.9 110.114 175.572 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 9.7 m . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 115.89 -0.595 . . . . 1.44 112.121 -172.33 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 70.4 mm-40 . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.847 0.356 . . . . 2.42 111.141 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.8 p -66.55 -18.99 65.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.107 -0.497 . . . . 1.25 111.473 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.656 ' HA ' HD22 ' A' ' 8' ' ' LEU . 11.8 m120 -64.27 -23.92 67.48 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.072 0.463 . . . . 1.78 110.19 176.643 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.969 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.2 tpp180 -56.88 -55.49 33.78 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.512 -0.767 . . . . 1.4 110.143 175.336 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.658 ' HB3' ' CE ' ' A' ' 47' ' ' LYS . 43.8 mt-10 -53.58 -49.93 66.69 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.409 -1.269 . . . . 0.68 111.434 -177.293 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.656 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.4 OUTLIER -51.91 -33.96 39.38 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.963 -1.017 . . . . 1.16 112.12 178.531 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.545 HG22 ' HE1' ' A' ' 104' ' ' PHE . 64.5 t -78.6 -59.35 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.719 0.771 . . . . 0.27 109.485 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.49 HG13 ' CE2' ' A' ' 24' ' ' TRP . 73.3 t -48.32 -57.32 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 114.223 -1.353 . . . . 0.33 113.099 -176.515 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -59.03 -31.77 69.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.698 0.285 . . . . 0.59 110.721 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.607 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.6 t80 -75.97 -44.62 38.94 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 116.265 -0.425 . . . . 1.61 110.444 -179.221 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.908 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.3 mp -60.43 -42.29 95.76 Favored 'General case' 0 CA--C 1.52 -0.185 0 C-N-CA 120.377 -0.529 . . . . 0.34 110.363 176.465 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.437 ' HA ' HD12 ' A' ' 17' ' ' LEU . 15.8 t -62.13 -40.2 95.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.097 -0.501 . . . . 1.05 109.89 177.777 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -59.71 -29.84 68.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.601 -0.727 . . . . 1.22 110.769 178.074 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.572 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 17.4 mmmt -78.6 -50.62 11.19 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.558 0.694 . . . . 1.41 110.506 -179.054 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.602 HD21 ' SG ' ' A' ' 111' ' ' CYS . 12.5 mt -56.52 -28.03 58.94 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 115.444 -0.798 . . . . 1.35 111.853 176.839 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.7 m -56.29 -44.67 80.06 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 112.362 0.504 . . . . 0.94 112.362 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 14.8 pt20 -75.46 0.12 18.23 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.31 0.576 . . . . 1.37 111.368 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.5 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.6 mmmt -109.53 -30.08 8.1 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.769 0.795 . . . . 2.2 109.199 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.99 24.06 9.35 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 114.134 -1.394 . . . . 0.53 111.139 178.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -115.2 160.5 19.65 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.079 0.466 . . . . 0.76 111.23 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.7 t -101.17 147.65 26.0 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.391 -0.822 . . . . 0.52 109.628 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.49 ' CE2' HG13 ' A' ' 10' ' ' VAL . 0.5 OUTLIER -79.31 -44.53 21.45 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.355 -0.609 . . . . 3.36 109.355 173.773 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.454 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 6.3 p -64.65 -32.94 74.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.384 -0.826 . . . . 1.37 111.76 -172.58 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -59.62 -24.29 63.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.136 0.493 . . . . 1.11 111.698 178.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.571 ' O ' ' HB2' ' A' ' 124' ' ' SER . 22.2 m-85 -120.46 13.57 11.82 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.898 -0.592 . . . . 1.28 110.897 -175.363 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.579 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 60.3 p -101.11 -178.53 3.77 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.923 0.712 . . . . 1.81 112.923 -170.815 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.599 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 4.2 t70 -170.54 -26.93 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.324 -1.307 . . . . 2.31 109.359 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.842 HG23 ' H ' ' A' ' 31' ' ' GLU . 10.7 m -45.16 -70.68 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-N 114.424 -1.262 . . . . 0.92 113.075 -173.745 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.842 ' H ' HG23 ' A' ' 30' ' ' VAL . 7.9 pt-20 -100.79 2.28 41.06 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.179 -0.675 . . . . 2.74 109.179 176.359 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.599 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.7 tt0 . . . . . 0 N--CA 1.45 -0.433 0 CA-C-N 114.798 -1.092 . . . . 1.45 111.38 -175.4 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.876 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.6 t . . . . . 0 CA--C 1.536 0.424 0 CA-C-O 120.831 0.348 . . . . 1.12 110.313 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.876 ' H ' HG23 ' A' ' 41' ' ' THR . 3.6 pt-20 -94.15 -28.87 15.44 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.281 1.039 . . . . 2.02 108.48 167.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.45 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.0 OUTLIER -56.34 -38.52 71.47 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 112.829 -1.987 . . . . 1.25 113.686 -169.826 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.508 ' HA ' ' CD ' ' A' ' 47' ' ' LYS . 13.8 tp10 -47.9 -56.1 8.33 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 117.903 0.319 . . . . 1.91 110.757 -174.218 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.512 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -66.14 -40.19 90.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.833 0.349 . . . . 0.52 110.743 178.096 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.761 ' HA ' HG12 ' A' ' 152' ' ' VAL . 84.8 t -56.75 -59.94 2.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.572 0.701 . . . . 1.41 111.134 178.554 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.658 ' CE ' ' HB3' ' A' ' 7' ' ' GLU . 4.2 ptmt -64.53 -30.77 71.8 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.811 -1.086 . . . . 0.67 109.837 -176.745 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.773 ' HB3' ' HB3' ' A' ' 157' ' ' ASN . 48.8 mm-40 -72.91 -27.35 61.81 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.566 -0.743 . . . . 0.99 110.882 177.841 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.659 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -79.7 -34.61 40.03 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.127 0.489 . . . . 0.42 109.814 175.254 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mp -62.73 -35.8 80.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.339 -0.846 . . . . 1.33 112.218 -178.031 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.422 ' HD3' ' OE1' ' A' ' 48' ' ' GLN . 11.6 ptm180 -68.99 -36.23 77.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.713 0.768 . . . . 2.17 109.585 178.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.559 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 6.6 mt-10 -80.74 -37.29 30.75 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.874 -1.057 . . . . 1.1 110.811 -174.198 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.42 -34.77 72.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.742 -0.663 . . . . 0.53 109.667 171.539 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.58 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.92 -50.69 61.55 Favored Glycine 0 C--O 1.223 -0.593 0 CA-C-N 115.342 -0.844 . . . . 0.7 112.431 179.043 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.607 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 28.1 t70 -54.29 -36.36 63.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.24 0.543 . . . . 1.04 111.099 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.533 ' O ' HD11 ' A' ' 59' ' ' LEU . 4.3 tt0 -76.98 -27.6 54.79 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.422 -0.808 . . . . 2.29 110.867 -178.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.485 ' CE1' ' HA2' ' B' 1012 ' ' GLY . 0.1 OUTLIER -82.87 -54.12 5.34 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.773 -0.649 . . . . 2.29 111.791 178.965 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.61 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 17.2 mt-10 -55.39 -54.5 42.91 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.975 0.731 . . . . 1.3 112.975 -168.331 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.731 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -42.48 -41.31 2.9 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.739 1.014 . . . . 1.54 113.739 -172.862 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.731 ' H ' HD12 ' A' ' 59' ' ' LEU . 36.4 mtm180 -59.41 -59.45 5.42 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 111.939 0.348 . . . . 2.58 111.939 -176.51 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.61 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -91.77 -5.67 53.14 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.052 0.76 . . . . 5.32 113.052 -175.352 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 24.6 ptt180 -66.42 -15.09 63.05 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 122.246 -0.284 . . . . 4.48 111.539 -175.746 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 63' ' ' ARG . 37.7 mtm105 -67.87 -15.95 63.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.243 -0.435 . . . . 4.72 111.438 179.336 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.744 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.38 -35.06 13.91 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.585 0.217 . . . . 1.17 111.585 175.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.653 ' HE1' HD11 ' B' 1008 ' ' LEU . 9.6 m-30 -43.32 -50.53 6.63 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.141 1.163 . . . . 2.81 114.141 -168.064 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.6 m -72.79 -20.53 61.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.101 0.477 . . . . 2.19 111.41 -171.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -90.41 -23.98 20.89 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.785 -0.643 . . . . 2.72 110.297 178.17 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.744 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 70.1 mt -77.65 -16.06 58.78 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 113.012 0.745 . . . . 1.56 113.012 -173.51 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.572 HG22 HG13 ' A' ' 74' ' ' ILE . 3.5 p -56.15 -28.9 59.78 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.27 0.47 . . . . 0.7 112.27 -172.526 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.2 t -67.37 -36.62 81.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.39 0.614 . . . . 1.34 109.823 175.539 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.453 ' OE1' HD22 ' A' ' 68' ' ' LEU . 71.6 mt-30 -72.43 -41.59 66.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.321 -0.854 . . . . 1.42 109.765 177.755 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.433 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.5 mm? -65.71 -32.2 73.61 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.05 -0.523 . . . . 1.37 110.921 176.905 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.423 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 38.6 m80 63.9 40.44 7.41 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.887 -0.783 . . . . 2.72 108.887 -173.612 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.576 HG21 ' HB3' ' A' ' 113' ' ' GLU . 35.9 mm -49.62 113.74 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-N 114.447 -1.251 . . . . 0.91 111.441 -178.198 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.775 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.81 -170.37 0.24 Allowed Pre-proline 0 CA--C 1.548 0.887 0 N-CA-C 107.922 -1.14 . . . . 0.51 107.922 -168.633 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.775 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.3 Cg_exo -28.71 166.88 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.089 1 C-N-CA 125.407 4.072 . . . . 0.47 115.537 162.857 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.87 -29.18 0.01 OUTLIER Glycine 0 N--CA 1.472 1.053 0 N-CA-C 117.261 1.664 . . . . 0.4 117.261 -173.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 81' ' ' GLN . 32.9 p -68.51 3.36 1.84 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 117.93 0.865 . . . . 0.56 111.997 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.64 -13.39 61.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.339 0.59 . . . . 0.34 109.564 170.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.435 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 50.2 t80 -75.45 -18.43 59.88 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 115.703 -0.68 . . . . 4.13 109.234 173.289 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.525 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 74.2 mt-30 -80.42 -26.99 38.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 122.199 1.0 . . . . 1.03 109.416 172.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m -78.09 -33.05 50.93 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.188 -1.369 . . . . 0.48 110.039 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.675 ' HB2' ' HG ' ' A' ' 110' ' ' LEU . 67.7 t80 -80.42 -17.07 52.89 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.583 0.706 . . . . 1.18 109.378 172.267 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.582 ' HA ' HG12 ' A' ' 87' ' ' VAL . 35.3 tt0 -68.2 -57.99 5.14 Favored 'General case' 0 CA--C 1.498 -1.054 0 CA-C-N 115.109 -0.95 . . . . 0.8 111.178 -174.704 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.573 ' HG3' ' N ' ' A' ' 86' ' ' VAL . 1.4 pt20 -43.95 -38.88 3.69 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 113.557 -1.656 . . . . 1.62 110.932 178.236 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.587 HG21 ' CE2' ' A' ' 106' ' ' PHE . 1.5 t -78.28 -53.94 13.11 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.734 0 CA-C-N 112.465 -2.152 . . . . 1.3 111.142 -177.746 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.582 HG12 ' HA ' ' A' ' 84' ' ' GLU . 8.6 p -60.73 -21.61 24.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 122.057 0.932 . . . . 0.85 109.445 -178.031 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.455 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 2.7 m-80 -70.96 -43.77 67.42 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 113.897 -1.501 . . . . 0.91 111.34 173.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.629 ' OE1' ' HA ' ' B' 1009 ' ' ALA . 2.0 pp20? -73.01 -37.56 66.92 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 121.767 0.794 . . . . 2.87 109.055 177.794 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.911 HD12 HH11 ' A' ' 99' ' ' ARG . 3.5 tp -66.74 -19.82 65.83 Favored 'General case' 0 N--CA 1.433 -1.31 0 CA-C-N 113.731 -1.577 . . . . 1.28 112.015 -165.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.652 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 2.6 p90 -110.64 -28.82 8.29 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 120.524 -0.471 . . . . 2.3 112.0 -173.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.549 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 9.9 ptm180 -72.94 -39.31 66.33 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.289 0.566 . . . . 5.06 111.534 -171.218 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -88.93 13.44 12.76 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.269 -0.878 . . . . 3.12 113.361 -169.618 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.593 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 128.46 70.66 0.14 Allowed Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 116.952 -2.547 . . . . 2.31 115.459 178.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.652 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 75.0 t -72.06 104.48 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 118.417 1.109 . . . . 1.06 111.066 178.606 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ASN . . . . . 0.553 ' HA ' HD22 ' A' ' 145' ' ' ASN . 1.4 m-20 -111.24 -170.22 1.6 Allowed 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.224 -1.353 . . . . 2.12 108.712 177.793 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 10.8 m-90 -56.1 -46.35 79.11 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 123.515 0.509 . . . . 3.34 111.192 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -79.05 -30.62 46.13 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.957 -0.64 . . . . 0.69 113.938 -175.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.911 HH11 HD12 ' A' ' 90' ' ' LEU . 16.6 mmt180 -55.61 -42.44 74.89 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 117.216 0.508 . . . . 4.24 111.553 -178.03 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.574 HG22 ' CE2' ' A' ' 104' ' ' PHE . 55.0 mt -67.8 -38.57 80.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.969 -0.56 . . . . 0.44 110.678 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 52.0 t -53.97 -54.18 22.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.937 -0.574 . . . . 1.35 110.033 172.183 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.4 ' O ' ' HB3' ' A' ' 105' ' ' SER . . . -55.68 -40.62 72.56 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.503 -0.772 . . . . 0.44 111.227 177.263 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.4 ' CD1' HG23 ' A' ' 87' ' ' VAL . 6.7 t80 -58.9 -40.96 86.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.372 -0.831 . . . . 1.49 111.069 177.472 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.574 ' CE2' HG22 ' A' ' 100' ' ' ILE . 39.1 m-85 -71.11 -34.09 70.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.694 0.283 . . . . 3.29 110.506 175.494 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.607 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 25.3 t -58.95 -57.49 12.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.078 -0.51 . . . . 1.19 111.127 178.165 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.587 ' CE2' HG21 ' A' ' 86' ' ' VAL . 34.6 t80 -68.11 -31.89 71.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 2.89 110.231 -178.452 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.483 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -67.3 -46.21 73.09 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.786 -0.721 . . . . 0.3 111.785 177.208 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.908 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.56 -31.98 81.84 Favored Glycine 0 N--CA 1.441 -0.982 0 C-N-CA 120.646 -0.787 . . . . 0.23 111.148 176.37 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.45 -30.56 67.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.577 -0.311 . . . . 0.31 110.526 175.511 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.675 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -65.02 -42.54 94.3 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 107.974 -1.121 . . . . 1.12 107.974 178.795 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.735 ' SG ' HG22 ' A' ' 123' ' ' VAL . 38.2 t -52.74 -54.8 28.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.101 -1.409 . . . . 0.26 110.479 172.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.5 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 73.8 t -62.97 -42.78 97.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.202 -0.453 . . . . 0.35 111.864 -177.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.576 ' HB3' HG21 ' A' ' 74' ' ' ILE . 3.4 mm-40 -59.08 -29.13 67.11 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.606 -0.438 . . . . 2.51 110.991 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.401 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 47.7 m -73.31 -39.23 65.45 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.963 -0.754 . . . . 0.28 108.963 176.331 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.639 ' HA ' ' HG3' ' A' ' 120' ' ' GLN . 80.5 t -67.07 -38.13 80.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.213 -0.903 . . . . 1.23 109.397 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -52.75 -50.44 63.48 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 113.364 -1.744 . . . . 0.6 111.338 -179.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 113' ' ' GLU . 20.7 mmtt -88.18 16.18 6.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.137 -0.483 . . . . 1.62 110.394 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 63.87 49.32 2.89 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.82 0.819 . . . . 1.88 110.729 178.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.564 ' HE1' HG22 ' A' ' 74' ' ' ILE . 26.4 mtm -130.67 44.69 2.92 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.627 -1.17 . . . . 0.31 108.203 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.639 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 0.0 OUTLIER -62.45 -6.99 3.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.283 -0.871 . . . . 1.15 112.958 -173.795 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.537 HG23 HD22 ' A' ' 122' ' ' LEU . 26.6 m -66.01 -21.85 29.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 O-C-N 122.14 -0.35 . . . . 0.46 111.577 176.422 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.688 HD13 ' HD3' ' A' ' 125' ' ' ARG . 3.3 mm? -75.53 -25.24 57.02 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 110.291 -0.263 . . . . 0.26 110.291 178.413 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.735 HG22 ' SG ' ' A' ' 111' ' ' CYS . 49.6 t -43.86 -53.63 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 123.917 0.761 . . . . 0.25 112.059 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.579 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 12.6 t -71.99 -37.77 69.8 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.853 -0.339 . . . . 1.35 110.718 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.688 ' HD3' HD13 ' A' ' 122' ' ' LEU . 63.7 mtp180 -61.0 -56.52 20.11 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.305 -0.407 . . . . 2.67 110.512 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.59 HG22 ' SD ' ' A' ' 130' ' ' MET . 70.7 mt -52.25 -50.67 36.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.807 -0.633 . . . . 0.23 110.305 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.8 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -57.18 -36.17 70.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.851 0.358 . . . . 0.29 111.378 179.036 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.969 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -63.54 -57.69 9.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.311 0.577 . . . . 0.28 110.556 176.137 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -66.72 -26.9 67.23 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.719 -1.128 . . . . 3.91 111.197 -174.687 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.59 ' SD ' HG22 ' A' ' 126' ' ' ILE . 89.7 mtp -69.23 -53.99 17.05 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.081 0.467 . . . . 1.08 110.972 175.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.511 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -59.33 -39.26 82.59 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.8 -0.636 . . . . 0.25 111.073 -178.259 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 86.7 m -63.56 -47.32 82.04 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.763 -0.375 . . . . 0.4 111.022 176.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.589 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 12.1 t80 -55.43 -39.35 70.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.178 0.514 . . . . 3.13 109.847 178.675 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.883 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.3 OUTLIER -59.91 -60.71 3.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.821 -0.627 . . . . 0.95 109.855 170.833 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -45.94 -44.36 14.72 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.054 -0.975 . . . . 0.46 113.245 -179.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -86.14 -51.87 6.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.989 0.423 . . . . 0.59 112.047 -178.313 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' HIS . . . . . 0.589 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 8.7 m80 -89.54 -49.7 6.52 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.889 0.7 . . . . 1.45 112.889 -168.788 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.883 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -76.71 -44.82 31.94 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 113.0 0.741 . . . . 1.2 113.0 -169.906 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.618 ' HA ' HD12 ' A' ' 142' ' ' ILE . 17.6 tt0 -42.23 -53.57 8.6 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.106 -0.952 . . . . 0.75 113.254 -171.576 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.545 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 24.3 Cg_exo -63.11 -42.55 22.76 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 121.76 1.64 . . . . 0.56 111.634 178.65 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' TRP . . . . . 0.507 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -56.8 -48.71 77.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.283 -0.871 . . . . 1.2 110.421 177.514 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.618 HD12 ' HA ' ' A' ' 139' ' ' GLU . 42.6 mt -49.76 -49.71 19.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.266 -0.879 . . . . 0.32 111.455 175.729 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.5 mm-40 -58.86 -32.64 69.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.543 -0.753 . . . . 0.57 111.355 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.1 mm-40 -66.42 -19.45 65.8 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.304 0.574 . . . . 0.78 111.1 176.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' ASN . . . . . 0.553 HD22 ' HA ' ' A' ' 96' ' ' ASN . 2.2 m120 -108.0 3.25 23.86 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.469 -0.787 . . . . 0.93 109.522 -175.759 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.32 -49.17 0.89 Allowed Glycine 0 N--CA 1.44 -1.081 0 CA-C-N 115.156 -0.929 . . . . 0.56 112.764 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' GLY . . . . . 0.447 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 139.66 178.95 17.19 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.765 -0.731 . . . . 0.49 111.757 -177.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.611 ' HZ2' ' HG3' ' A' ' 139' ' ' GLU . 19.0 m-90 -68.41 -42.53 78.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.694 0.283 . . . . 3.57 110.614 -178.646 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 3.5 m-20 -57.75 -33.91 68.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 1.96 110.369 176.582 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.539 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 50.2 m -59.71 -40.77 89.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.116 -0.493 . . . . 0.67 111.488 178.555 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.56 ' CD2' ' HA ' ' A' ' 148' ' ' TRP . 19.5 m-85 -59.75 -36.16 76.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.248 0.547 . . . . 3.0 109.756 -178.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.761 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.4 m -81.28 -24.54 10.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.652 -0.703 . . . . 1.15 110.17 178.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 11.2 mm-40 -59.19 -26.68 65.01 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.123 0.487 . . . . 1.67 109.964 171.044 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 150' ' ' THR . 1.4 mt -97.53 -55.22 2.89 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.718 -0.673 . . . . 1.3 110.737 179.62 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 56.3 m-85 -112.47 16.98 19.65 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.059 -0.518 . . . . 4.24 111.749 -170.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.659 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -63.8 159.77 38.74 Favored Glycine 0 CA--C 1.497 -1.071 0 CA-C-O 122.605 1.114 . . . . 1.1 115.164 -168.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.773 ' HB3' ' HB3' ' A' ' 48' ' ' GLN . 46.5 t-20 . . . . . 0 N--CA 1.426 -1.652 0 CA-C-N 112.599 -1.8 . . . . 1.29 109.68 -174.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.124 0 N-CA-C 113.829 0.292 . . . . 1.2 113.829 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -98.43 -13.59 20.51 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 113.027 0.751 . . . . 2.88 113.027 177.217 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -97.13 -53.09 3.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.306 0.484 . . . . 1.31 112.306 -170.388 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.653 HD11 ' HE1' ' A' ' 65' ' ' PHE . 2.7 mm? -64.38 -46.93 81.24 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.832 -0.803 . . . . 1.33 108.832 178.386 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B 1009 ' ' ALA . . . . . 0.629 ' HA ' ' OE1' ' A' ' 89' ' ' GLU . . . -38.96 -51.8 1.79 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.326 -1.306 . . . . 0.88 111.739 167.75 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -77.67 -55.6 5.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.536 -1.211 . . . . 1.03 111.975 -173.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -66.02 -21.74 66.41 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.157 -0.474 . . . . 1.67 110.692 -178.309 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1012 ' ' GLY . . . . . 0.485 ' HA2' ' CE1' ' A' ' 57' ' ' PHE . . . -80.27 -5.61 89.64 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.836 -0.62 . . . . 0.78 112.796 -179.661 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.8 t70 -82.65 -8.78 59.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.323 0.583 . . . . 1.9 109.892 174.425 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 3.2 m . . . . . 0 N--CA 1.45 -0.471 0 N-CA-C 108.488 -0.93 . . . . 1.44 108.488 -179.986 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 . . . . . 0 C--O 1.223 -0.335 0 CA-C-O 120.884 0.373 . . . . 2.42 110.153 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.445 ' O ' HD13 ' A' ' 8' ' ' LEU . 1.7 p -60.27 -23.29 64.01 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.838 -0.619 . . . . 1.25 112.03 -179.071 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.576 ' HA ' HD22 ' A' ' 8' ' ' LEU . 3.9 p30 -67.58 -22.32 65.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.931 -0.577 . . . . 1.78 111.115 176.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.843 HH12 ' HA ' ' A' ' 128' ' ' ALA . 23.9 tpp180 -58.23 -50.69 72.67 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.235 0.541 . . . . 1.4 109.864 175.321 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.511 ' OE1' ' HB2' ' A' ' 43' ' ' SER . 33.6 mt-10 -50.62 -55.71 15.13 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.324 -1.307 . . . . 0.68 110.808 -179.084 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.576 HD22 ' HA ' ' A' ' 5' ' ' ASN . 2.8 mp -43.61 -45.97 7.01 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.151 -0.931 . . . . 1.16 111.345 176.694 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.5 t -70.2 -60.74 2.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.121 0.486 . . . . 0.27 110.662 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 6' ' ' ARG . 63.7 t -53.57 -53.46 25.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.482 -0.781 . . . . 0.33 112.477 -175.275 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -54.25 -35.37 62.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.483 -0.78 . . . . 0.59 111.126 -175.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.57 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 15.2 t80 -88.34 -37.33 16.03 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 120.478 -0.489 . . . . 1.61 112.14 -175.538 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 1.013 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 2.8 mp -60.43 -36.93 79.34 Favored 'General case' 0 CA--C 1.521 -0.152 0 C-N-CA 119.386 -0.926 . . . . 0.34 109.301 176.277 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.528 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 35.7 t -63.35 -37.37 87.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.642 -0.708 . . . . 1.05 110.354 175.255 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -71.41 -26.09 62.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.666 -0.697 . . . . 1.22 110.48 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.57 ' HG2' ' O ' ' A' ' 12' ' ' PHE . 12.8 mmmt -75.86 -43.15 47.06 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 112.133 0.42 . . . . 1.41 112.133 -179.227 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.58 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -59.53 -19.08 45.74 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.672 0.272 . . . . 1.35 111.327 177.139 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.1 t -60.37 -44.32 95.71 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.322 0.489 . . . . 0.94 112.322 -176.724 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -66.97 -10.54 50.51 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.631 0.729 . . . . 1.37 111.673 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.417 ' HD3' HG11 ' A' ' 112' ' ' VAL . 19.8 mmmt -105.85 -30.2 9.53 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 122.079 0.942 . . . . 2.2 108.936 -177.286 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.17 19.34 21.6 Favored Glycine 0 N--CA 1.442 -0.948 0 CA-C-N 114.297 -1.32 . . . . 0.53 111.622 175.165 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -102.38 162.88 12.57 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.771 0.319 . . . . 0.76 110.852 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.2 t -98.11 149.86 22.06 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 115.961 -0.563 . . . . 0.52 110.397 178.492 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.596 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 52.4 t-105 -77.84 -52.72 8.44 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.225 -0.898 . . . . 3.36 109.968 174.446 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.7 m -68.49 -22.16 64.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.823 -0.626 . . . . 1.37 112.248 -172.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -67.2 -27.69 67.47 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.745 -0.382 . . . . 1.11 111.73 178.565 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -115.58 -8.48 12.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.215 -0.448 . . . . 1.28 111.894 -174.42 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.639 ' HB3' HG22 ' A' ' 30' ' ' VAL . 49.5 m -101.66 154.34 18.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.715 0.769 . . . . 1.81 113.066 -174.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.534 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.8 t70 -115.58 -14.8 11.48 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 113.879 -1.509 . . . . 2.31 109.828 -179.512 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.856 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.0 m -48.48 -73.01 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.463 -1.244 . . . . 0.92 113.092 -167.74 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.856 ' H ' HG23 ' A' ' 30' ' ' VAL . 44.2 mt-10 -92.14 0.89 57.47 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.561 -0.533 . . . . 2.74 109.561 176.52 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.534 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.9 tt0 . . . . . 0 N--CA 1.45 -0.466 0 CA-C-N 115.547 -0.751 . . . . 1.45 110.482 -178.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.833 HG23 ' H ' ' A' ' 42' ' ' GLU . 2.2 t . . . . . 0 CA--C 1.538 0.509 0 CA-C-O 120.13 0.014 . . . . 1.12 111.022 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.833 ' H ' HG23 ' A' ' 41' ' ' THR . 13.9 pt-20 -92.91 -30.99 15.11 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 122.374 1.083 . . . . 2.02 109.454 174.4 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.805 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 66.3 m -69.84 -16.63 63.29 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 113.218 -1.81 . . . . 1.25 114.323 -167.159 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -42.81 -41.85 3.39 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 118.254 0.479 . . . . 1.91 111.831 -178.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.44 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -83.65 -42.29 16.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.075 0.464 . . . . 0.52 110.47 174.26 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.701 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 75.9 t -46.95 -66.91 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 C-N-CA 124.05 0.94 . . . . 1.41 111.857 175.289 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.805 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.7 ptpt -61.27 -38.1 85.52 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.742 -0.663 . . . . 0.67 110.462 -177.244 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.581 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 6.6 mm-40 -59.61 -27.23 66.12 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 116.233 -0.44 . . . . 0.99 110.958 175.365 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.812 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -83.84 -45.75 12.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.235 0.541 . . . . 0.42 110.413 172.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.686 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -49.05 -42.25 37.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.826 -1.079 . . . . 1.33 112.003 -179.697 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.631 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 8.4 ptp180 -76.88 -28.45 55.4 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.336 0.589 . . . . 2.17 110.017 -170.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.438 ' HG2' ' HG3' ' A' ' 51' ' ' ARG . 19.1 mm-40 -77.85 -44.18 28.05 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.911 -1.041 . . . . 1.1 110.182 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.21 -43.46 98.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.665 -0.698 . . . . 0.53 109.695 174.327 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.699 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.87 -41.46 99.87 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-N 115.556 -0.747 . . . . 0.7 111.48 175.054 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -52.56 -39.3 61.32 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 122.786 0.434 . . . . 1.04 111.123 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.419 ' HA ' HD11 ' A' ' 59' ' ' LEU . 50.7 mt-10 -80.05 -27.19 39.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.12 -0.491 . . . . 2.29 111.498 178.303 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.908 ' HZ ' ' HA2' ' B' 1012 ' ' GLY . 1.4 t80 -80.84 -27.46 36.46 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.537 -0.301 . . . . 2.29 111.235 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.798 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 47.7 mt-10 -56.26 -65.48 0.6 Allowed 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 111.932 0.345 . . . . 1.3 111.932 -176.456 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.79 HD13 ' H ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -52.05 -35.44 47.31 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.323 0.39 . . . . 1.54 111.337 -178.616 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.704 ' N ' HD22 ' A' ' 59' ' ' LEU . 46.0 mtt180 -52.83 -55.18 24.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.58 -0.736 . . . . 2.58 111.756 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.798 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 29.3 p90 -90.78 -19.68 23.21 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.682 -0.407 . . . . 5.32 111.757 -177.436 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -58.81 -30.11 67.39 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 122.681 0.392 . . . . 4.48 111.55 -174.744 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -62.64 -37.16 85.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 4.72 110.685 178.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.464 ' HB1' HD13 ' A' ' 68' ' ' LEU . . . -90.41 -31.23 16.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.426 . . . . 1.17 110.807 178.115 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.585 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 56.9 t80 -42.55 -48.47 5.34 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.821 0.848 . . . . 2.81 113.199 -174.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.5 t -62.75 -38.14 89.37 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.861 0.362 . . . . 2.19 110.945 -174.423 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -87.57 -28.14 22.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.0 0.429 . . . . 2.72 110.762 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.503 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 0.5 OUTLIER -60.13 -22.5 62.91 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 113.099 0.777 . . . . 1.56 113.099 -175.349 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.456 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 4.8 p -52.99 -26.99 17.09 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 117.999 0.363 . . . . 0.7 111.391 -179.549 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.7 t -58.98 -58.25 9.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.377 0.608 . . . . 1.34 110.055 173.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.503 ' OE1' ' HA ' ' A' ' 68' ' ' LEU . 21.4 mp0 -51.35 -45.59 62.41 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 124.397 1.079 . . . . 1.42 111.161 174.477 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.49 ' HB3' ' CD1' ' A' ' 74' ' ' ILE . 2.4 mm? -66.62 -31.86 72.82 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 116.056 -0.52 . . . . 1.37 111.834 179.082 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.9 m80 57.1 42.64 25.49 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.65 -0.87 . . . . 2.72 108.65 -174.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.508 HG22 ' HE1' ' A' ' 119' ' ' MET . 31.9 mm -49.67 115.66 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 113.582 -1.644 . . . . 0.91 113.141 -173.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.772 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -157.04 -171.61 0.29 Allowed Pre-proline 0 CA--C 1.551 0.988 0 CA-C-N 114.272 -1.331 . . . . 0.51 107.798 -171.796 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.772 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 41.0 Cg_exo -28.63 166.67 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.335 1 C-N-CA 125.453 4.102 . . . . 0.47 115.976 164.895 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.416 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -31.5 -27.17 0.01 OUTLIER Glycine 0 N--CA 1.474 1.203 0 N-CA-C 117.441 1.737 . . . . 0.4 117.441 -173.078 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.432 ' N ' ' O ' ' A' ' 76' ' ' PRO . 24.1 p -69.39 4.34 1.81 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 117.888 0.844 . . . . 0.56 112.007 -179.446 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.19 -14.58 63.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 121.393 0.616 . . . . 0.34 109.742 172.274 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -76.6 -14.73 59.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.687 -0.688 . . . . 4.13 109.92 176.032 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.496 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 37.3 mt-30 -86.99 -24.11 24.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.623 0.725 . . . . 1.03 109.978 173.539 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.0 m -71.22 -51.19 26.08 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.711 -1.131 . . . . 0.48 109.249 170.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -68.2 -15.94 63.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.82 -1.082 . . . . 1.18 110.202 174.123 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.629 ' HA ' HG12 ' A' ' 87' ' ' VAL . 41.5 tt0 -64.22 -50.55 67.6 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.172 0.51 . . . . 0.8 110.257 176.818 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.403 ' HG3' ' H ' ' A' ' 85' ' ' GLN . 53.4 mt-30 -44.43 -43.63 7.87 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 114.414 -1.266 . . . . 1.62 111.302 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.676 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.6 p -91.45 -36.77 8.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 CA-C-N 113.546 -1.661 . . . . 1.3 112.039 -171.821 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.629 HG12 ' HA ' ' A' ' 84' ' ' GLU . 6.9 p -66.38 -21.31 28.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 121.845 0.831 . . . . 0.85 109.277 175.333 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.609 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.5 m-80 -72.74 -51.47 19.04 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.193 -1.367 . . . . 0.91 111.137 175.813 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 1.024 ' HG2' ' HA2' ' B' 1005 ' ' GLY . 0.0 OUTLIER -64.96 -40.04 94.39 Favored 'General case' 0 CA--C 1.496 -1.109 0 N-CA-C 108.77 -0.826 . . . . 2.87 108.77 -178.622 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.618 ' HG ' ' OE1' ' A' ' 89' ' ' GLU . 15.5 mt -57.21 -27.08 61.68 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-N 113.851 -1.522 . . . . 1.28 110.8 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.621 ' HA ' HG22 ' A' ' 95' ' ' VAL . 76.4 t80 -97.4 -49.05 5.06 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.341 0.591 . . . . 2.3 110.727 -171.569 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.609 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER -75.56 -32.77 60.52 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.595 -0.73 . . . . 5.06 110.885 -173.095 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.518 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 1.4 m-20 -94.55 20.17 8.81 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.676 -0.693 . . . . 3.12 112.549 -174.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.69 70.97 0.11 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 117.182 -2.437 . . . . 2.31 116.116 177.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 1.042 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 46.6 t -75.88 98.86 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 118.927 1.363 . . . . 1.06 111.271 171.714 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -113.35 -170.94 1.78 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.953 -1.021 . . . . 2.12 109.601 177.146 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.685 ' HA ' ' CE2' ' A' ' 151' ' ' PHE . 13.6 m-90 -61.79 -46.7 88.42 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.112 -0.495 . . . . 3.34 110.643 178.297 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.422 ' HA2' HG13 ' A' ' 101' ' ' VAL . . . -78.54 -20.37 71.73 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.89 -0.595 . . . . 0.69 113.9 -174.682 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 1.042 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -68.91 -30.57 69.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 117.336 0.568 . . . . 4.24 110.0 -176.335 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 85.4 mt -76.76 -32.36 20.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.329 -0.396 . . . . 0.44 110.642 -178.019 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.429 ' HA ' ' CD1' ' A' ' 104' ' ' PHE . 0.8 OUTLIER -63.84 -26.48 40.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-O 121.321 0.581 . . . . 1.35 109.51 172.038 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -73.77 -49.24 26.37 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.396 -0.594 . . . . 0.44 109.396 173.221 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.665 ' HB2' ' NH1' ' A' ' 99' ' ' ARG . 32.7 t80 -49.93 -55.42 14.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.731 -1.122 . . . . 1.49 111.697 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.517 ' HA ' ' CE ' ' A' ' 130' ' ' MET . 0.2 OUTLIER -72.54 -18.46 61.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.974 0.416 . . . . 3.29 110.733 -174.278 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.561 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 23.0 t -81.75 -44.32 17.18 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.219 -0.446 . . . . 1.19 110.524 177.475 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.566 ' CZ ' HD12 ' B' 1008 ' ' LEU . 19.9 m-30 -65.41 -39.92 92.74 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 116.441 -0.345 . . . . 2.89 110.107 178.556 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLY . . . . . 0.839 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -64.49 -37.25 94.19 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.821 -0.704 . . . . 0.3 111.673 176.695 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 1.013 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.9 -34.56 87.5 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 120.539 -0.839 . . . . 0.23 111.407 175.168 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.585 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -72.23 -34.1 68.06 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.8 0.333 . . . . 0.31 110.463 176.683 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.565 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -60.65 -40.14 90.93 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 122.21 1.005 . . . . 1.12 108.514 179.564 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.692 ' HB2' HD23 ' A' ' 13' ' ' LEU . 33.3 t -52.74 -53.92 41.11 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 113.74 -1.573 . . . . 0.26 110.344 173.322 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.417 HG11 ' HD3' ' A' ' 20' ' ' LYS . 54.4 t -61.21 -42.32 92.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.031 -0.531 . . . . 0.35 111.54 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.487 ' HB3' HG21 ' A' ' 74' ' ' ILE . 32.1 mt-10 -55.41 -34.11 64.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.053 0.454 . . . . 2.51 110.797 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.447 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 30.3 m -74.14 -38.09 63.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.466 0.65 . . . . 0.28 109.268 178.659 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.644 ' HA ' ' HG3' ' A' ' 120' ' ' GLN . 85.9 t -67.51 -34.29 67.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 115.127 -0.942 . . . . 1.23 109.538 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.48 -50.31 60.1 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.594 -1.639 . . . . 0.6 111.381 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 10.6 mmtp -89.74 11.9 18.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.03 -0.532 . . . . 1.62 110.541 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 61.8 56.29 2.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.93 0.871 . . . . 1.88 110.588 -176.601 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.508 ' HE1' HG22 ' A' ' 74' ' ' ILE . 32.7 mtm -129.44 43.68 3.1 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.388 -1.278 . . . . 0.31 107.61 178.034 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.644 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 14.1 mp0 -61.35 -7.14 2.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.877 -1.056 . . . . 1.15 113.199 -172.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.597 HG23 HD22 ' A' ' 122' ' ' LEU . 17.9 m -62.94 -28.53 45.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 O-C-N 121.916 -0.49 . . . . 0.46 111.187 173.285 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.755 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.4 mm? -69.36 -28.08 65.89 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 110.267 -0.271 . . . . 0.26 110.267 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.691 HG22 ' SG ' ' A' ' 111' ' ' CYS . 54.7 t -43.04 -53.91 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 O-C-N 123.955 0.784 . . . . 0.25 112.124 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.604 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 3.3 t -75.1 -34.89 61.78 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.877 0.37 . . . . 1.35 110.662 -178.484 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.755 ' HD2' HD13 ' A' ' 122' ' ' LEU . 93.0 mtt180 -64.22 -50.28 68.63 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.081 -0.509 . . . . 2.67 110.803 -177.043 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.565 HD13 ' HB3' ' A' ' 110' ' ' LEU . 75.8 mt -55.12 -50.03 67.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.675 -0.693 . . . . 0.23 110.614 179.361 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.596 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -56.7 -34.2 67.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.408 -0.36 . . . . 0.29 111.639 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.843 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -59.41 -61.93 2.26 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.36 0.6 . . . . 0.28 110.448 175.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -62.17 -31.87 72.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.853 -1.067 . . . . 3.91 111.258 -177.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.839 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 7.5 mmm -61.91 -59.83 4.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.212 -0.449 . . . . 1.08 111.683 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -64.01 -36.32 83.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.429 -0.35 . . . . 0.25 110.78 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' THR . . . . . 0.453 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 52.1 m -66.9 -39.21 87.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.416 -0.356 . . . . 0.4 111.127 177.323 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' TYR . . . . . 0.547 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 55.4 t80 -60.31 -43.16 96.6 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.801 -0.444 . . . . 3.13 109.801 175.931 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.54 HD13 ' HB2' ' A' ' 5' ' ' ASN . 5.7 tt -60.34 -50.27 74.29 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.745 -0.835 . . . . 0.95 108.745 174.346 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' ASN . . . . . 0.453 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 3.8 m-80 -48.98 -58.31 5.1 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.932 -0.576 . . . . 0.46 112.443 178.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -80.23 -45.03 18.7 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 0.59 112.054 -172.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' HIS . . . . . 0.547 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 9.4 m-70 -91.97 -50.55 5.65 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.361 0.874 . . . . 1.45 113.361 -171.155 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.539 HD21 ' NH2' ' A' ' 99' ' ' ARG . 58.8 mt -91.75 -34.96 14.41 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.607 0.966 . . . . 1.2 113.607 -165.319 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.627 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 31.7 tt0 -51.38 -49.84 79.75 Favored Pre-proline 0 C--N 1.324 -0.526 0 O-C-N 123.313 0.383 . . . . 0.75 111.657 -174.468 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 52.8 Cg_exo -52.87 -51.31 11.39 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 121.772 1.648 . . . . 0.56 111.624 175.316 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -54.5 -54.22 43.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.45 -0.795 . . . . 1.2 110.544 178.569 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.575 HD12 ' HA ' ' A' ' 139' ' ' GLU . 13.6 mt -42.84 -51.84 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.406 -0.815 . . . . 0.32 111.961 175.262 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.627 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 14.8 mm-40 -67.07 -30.01 69.94 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.934 -0.576 . . . . 0.57 111.747 -176.323 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.0 mm-40 -68.28 -22.28 64.75 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.498 0.666 . . . . 0.78 110.7 175.24 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -101.72 3.84 40.03 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.28 -0.873 . . . . 0.93 108.974 -174.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 125.48 -34.02 3.45 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.696 -1.138 . . . . 0.56 113.135 173.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 111.7 162.92 17.18 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 111.1 -0.8 . . . . 0.49 111.1 -174.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.659 ' HB3' HG22 ' A' ' 46' ' ' VAL . 39.9 m95 -58.21 -33.59 69.48 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.124 0.787 . . . . 3.57 113.124 -172.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.515 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 29.8 m-20 -56.56 -42.87 79.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.852 0.358 . . . . 1.96 110.082 176.068 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 150' ' ' THR . . . . . 0.524 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 25.1 m -60.59 -36.48 78.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.733 -0.667 . . . . 0.67 111.721 179.064 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 151' ' ' PHE . . . . . 0.685 ' CE2' ' HA ' ' A' ' 97' ' ' TRP . 2.2 m-85 -62.81 -39.68 95.04 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.184 0.516 . . . . 3.0 109.641 -177.714 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.621 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.4 m -75.5 -24.44 17.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.859 -0.61 . . . . 1.15 110.053 176.114 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 12.8 mm-40 -60.88 -23.46 65.2 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 121.672 -0.642 . . . . 1.67 110.478 173.75 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 154' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.6 mt -96.23 -56.04 2.76 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.886 -0.597 . . . . 1.3 110.101 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 155' ' ' TYR . . . . . 0.668 ' OH ' ' HB3' ' A' ' 151' ' ' PHE . 12.0 p90 -121.55 26.51 8.75 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.289 0.566 . . . . 4.24 112.49 -173.161 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.812 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -61.48 161.4 26.68 Favored Glycine 0 C--N 1.305 -1.185 0 CA-C-N 115.165 -0.925 . . . . 1.1 113.442 -178.003 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.581 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 4.6 t30 . . . . . 0 C--N 1.31 -1.117 0 CA-C-N 114.011 -1.094 . . . . 1.29 111.299 179.764 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1005 ' ' GLY . . . . . 1.024 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.535 1.302 0 N-CA-C 114.984 0.754 . . . . 1.2 114.984 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 8.2 mpt_? -85.77 -33.83 21.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 117.635 0.717 . . . . 2.88 111.636 175.495 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -95.15 -55.58 3.02 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.527 0.566 . . . . 1.31 112.527 -167.518 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.671 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 2.9 mm? -65.89 -44.26 85.8 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.705 -0.48 . . . . 1.33 109.705 -175.702 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B 1009 ' ' ALA . . . . . 0.965 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -42.93 -44.5 4.61 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 122.474 1.13 . . . . 0.88 110.502 172.095 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -79.92 -51.16 9.45 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 113.467 -1.697 . . . . 1.03 111.204 -175.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -66.61 -19.84 65.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.152 -0.476 . . . . 1.67 110.913 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1012 ' ' GLY . . . . . 0.908 ' HA2' ' HZ ' ' A' ' 57' ' ' PHE . . . -82.23 -2.6 90.62 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 116.006 -0.543 . . . . 0.78 113.033 -178.046 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 39.0 t70 -88.6 7.1 35.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.539 0.685 . . . . 1.9 109.933 170.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 2.7 m . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 115.949 -0.568 . . . . 1.44 110.158 178.182 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.413 ' O ' ' HB3' ' A' ' 6' ' ' ARG . 2.0 mp0 . . . . . 0 N--CA 1.457 -0.077 0 CA-C-O 120.693 0.282 . . . . 2.42 111.091 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.2 p -63.96 -37.19 86.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.477 -0.329 . . . . 1.25 111.137 -179.791 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.622 ' HA ' HD13 ' A' ' 8' ' ' LEU . 23.9 p30 -64.65 -17.11 63.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.684 0.278 . . . . 1.78 110.869 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.519 ' NH1' ' HA ' ' A' ' 128' ' ' ALA . 9.9 tpp180 -60.22 -39.7 87.56 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.056 0.455 . . . . 1.4 109.85 178.999 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -64.41 -42.54 96.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.625 -0.716 . . . . 0.68 110.423 179.579 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.622 HD13 ' HA ' ' A' ' 5' ' ' ASN . 8.9 mp -54.36 -39.56 67.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.812 -0.631 . . . . 1.16 110.401 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.422 HG13 ' HE2' ' A' ' 130' ' ' MET . 91.6 t -73.37 -64.8 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.927 -0.579 . . . . 0.27 110.086 178.98 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.418 HG21 ' OE2' ' A' ' 31' ' ' GLU . 52.4 t -44.8 -66.77 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.254 -0.884 . . . . 0.33 112.178 -179.969 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -43.32 -33.58 1.03 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.59 112.137 -179.226 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.44 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.2 t80 -77.33 -46.68 22.15 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.107 -0.237 . . . . 1.61 111.221 -179.556 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.654 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 10.0 mp -60.45 -37.51 81.2 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.948 0.404 . . . . 0.34 110.525 179.536 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.46 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 38.3 t -68.13 -42.51 80.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.873 -0.603 . . . . 1.05 110.195 179.635 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -68.9 -24.28 64.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.713 -0.676 . . . . 1.22 110.442 179.596 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.541 ' HG3' HG21 ' A' ' 112' ' ' VAL . 1.9 tppt? -85.34 -16.52 39.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.942 -0.572 . . . . 1.41 110.775 -179.761 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 mp -90.04 -13.92 34.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.072 -0.513 . . . . 1.35 110.116 179.263 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 72.6 m -75.27 -35.88 61.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.788 -0.642 . . . . 0.94 110.728 179.702 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -70.55 -4.84 25.04 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.318 -0.401 . . . . 1.37 110.473 179.769 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.462 ' HG3' HG13 ' A' ' 112' ' ' VAL . 29.7 mmmt -109.51 -26.04 10.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.849 -0.614 . . . . 2.2 110.775 -179.845 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.03 4.29 44.88 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.841 -0.695 . . . . 0.53 111.98 -179.402 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -102.1 160.9 14.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.854 0.359 . . . . 0.76 110.855 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.1 t -110.79 138.73 46.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.063 -0.517 . . . . 0.52 110.573 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.46 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 11.6 t90 -68.01 -45.36 74.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.066 -0.516 . . . . 3.36 111.085 -179.934 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.463 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 50.9 m -56.96 -41.68 78.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 1.37 111.834 -179.369 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -56.59 -24.02 44.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.298 -0.41 . . . . 1.11 112.044 -179.227 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.402 ' CG ' ' HB3' ' A' ' 120' ' ' GLN . 29.1 m-85 -126.7 16.0 7.52 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.878 0.325 . . . . 1.28 111.878 -179.08 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.539 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 83.6 p -99.9 -179.99 4.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.12 0.486 . . . . 1.81 111.413 -179.792 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.465 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 9.7 t70 -166.07 -15.34 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.394 -0.821 . . . . 2.31 109.868 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.701 HG23 ' H ' ' A' ' 31' ' ' GLU . 0.6 OUTLIER -58.58 -75.99 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.319 -0.855 . . . . 0.92 111.809 -179.833 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.701 ' H ' HG23 ' A' ' 30' ' ' VAL . 42.8 mt-10 -87.5 -3.43 59.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.927 0.394 . . . . 2.74 110.682 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.465 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 38.7 tt0 . . . . . 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 1.45 111.367 -179.627 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.607 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.95 0.405 . . . . 1.12 110.491 . . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.607 ' H ' HG23 ' A' ' 41' ' ' THR . 12.2 pt-20 -124.07 -19.6 5.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.423 0.63 . . . . 2.02 109.377 179.084 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.739 ' HA ' HG22 ' A' ' 46' ' ' VAL . 27.1 m -72.77 -23.34 60.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.918 -1.037 . . . . 1.25 112.409 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -52.28 -36.36 52.59 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.094 0.405 . . . . 1.91 112.094 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.452 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -91.81 -36.17 13.68 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.172 0.434 . . . . 0.52 112.172 -179.024 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.739 HG22 ' HA ' ' A' ' 43' ' ' SER . 1.5 m -75.27 -28.12 20.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 111.876 0.324 . . . . 1.41 111.876 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.6 ptmt -77.94 -34.21 51.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.887 0.375 . . . . 0.67 110.121 -179.794 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.495 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 68.5 mm-40 -68.61 -36.32 78.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.861 -0.609 . . . . 0.99 109.423 178.745 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.445 ' HB2' HG23 ' A' ' 152' ' ' VAL . . . -77.59 -31.7 53.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.532 -0.758 . . . . 0.42 109.47 178.544 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.566 HD21 ' CD2' ' A' ' 104' ' ' PHE . 28.9 tp -67.41 -31.65 72.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.972 -1.013 . . . . 1.33 110.082 179.39 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -70.06 -40.45 75.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.263 -0.881 . . . . 2.17 110.543 179.6 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.9 -45.97 69.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.927 -0.579 . . . . 1.1 110.707 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.99 -36.54 83.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 0.53 110.925 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.442 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -72.0 -37.88 60.14 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.811 -0.709 . . . . 0.7 112.395 -179.985 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -55.35 -43.81 75.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.69 0.281 . . . . 1.04 111.386 -179.798 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -72.65 -16.68 61.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.335 -0.393 . . . . 2.29 111.49 -179.602 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -90.33 -31.46 16.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.578 -0.283 . . . . 2.29 111.26 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.442 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 49.2 mt-10 -63.84 -60.79 2.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.428 -0.351 . . . . 1.3 111.549 -179.523 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.469 HD12 ' N ' ' A' ' 60' ' ' ARG . 3.8 pp -54.97 -20.42 9.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.055 -0.521 . . . . 1.54 111.758 -179.347 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.469 ' N ' HD12 ' A' ' 59' ' ' LEU . 23.4 ttm180 -66.66 -38.5 86.97 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.2 0.445 . . . . 2.58 112.2 -178.818 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -129.63 15.15 5.97 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.133 -0.227 . . . . 5.32 111.449 -179.389 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.408 ' HA ' ' HB3' ' A' ' 65' ' ' PHE . 29.3 ttm180 -50.49 -47.0 57.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.501 -0.318 . . . . 4.48 111.642 -179.685 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -32.33 54.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.171 -0.468 . . . . 4.72 111.61 -179.2 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.421 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -91.22 -26.51 18.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.909 0.385 . . . . 1.17 111.083 179.903 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.534 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -58.31 -39.25 78.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.944 -0.571 . . . . 2.81 111.635 -179.33 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 69.6 m -76.5 -25.7 54.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.798 0.332 . . . . 2.19 111.16 -179.881 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -93.7 -12.33 29.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.155 -0.475 . . . . 2.72 111.045 -179.463 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.421 HD13 ' O ' ' A' ' 64' ' ' ALA . 2.2 mp -80.91 -9.04 59.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 1.56 111.143 -179.491 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.433 HG22 ' OE1' ' A' ' 113' ' ' GLU . 46.0 p -59.8 -31.03 69.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.7 110.874 179.765 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -77.01 -36.88 55.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.962 -0.563 . . . . 1.34 110.74 179.842 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -74.53 -23.62 58.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 1.42 110.534 179.78 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.457 HD11 ' HZ ' ' A' ' 106' ' ' PHE . 44.7 mt -92.87 -18.22 23.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.811 -0.632 . . . . 1.37 110.989 -179.903 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 m80 55.69 49.46 16.3 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 110.117 -0.327 . . . . 2.72 110.117 -179.081 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.535 HG13 ' HB3' ' A' ' 113' ' ' GLU . 37.8 mm -49.56 93.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.991 -0.549 . . . . 0.91 110.968 -179.755 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.556 ' O ' ' HB2' ' A' ' 79' ' ' ALA . 0.4 OUTLIER -130.94 164.6 40.96 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 115.478 -0.783 . . . . 0.51 110.028 -179.368 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.515 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 12.4 Cg_endo -55.62 142.07 82.58 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.191 1.928 . . . . 0.47 113.61 -179.234 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.702 ' H ' HD11 ' A' ' 122' ' ' LEU . . . 63.92 -77.56 0.05 OUTLIER Glycine 0 CA--C 1.52 0.401 0 CA-C-N 115.464 -0.789 . . . . 0.4 114.828 178.17 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 58.9 p -55.05 -4.83 0.08 Allowed 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 113.652 0.982 . . . . 0.56 113.652 -177.931 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.556 ' HB2' ' O ' ' A' ' 75' ' ' THR . . . -60.11 -24.8 64.95 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 121.483 0.659 . . . . 0.34 109.233 178.447 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -69.1 -32.83 72.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.83 -1.077 . . . . 4.13 110.091 179.242 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.412 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 51.7 mt-30 -72.48 -25.47 61.44 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.269 0.557 . . . . 1.03 109.623 178.532 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.3 m -75.73 -40.44 55.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.442 -0.799 . . . . 0.48 108.9 178.548 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -74.89 -14.59 60.68 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.921 -1.036 . . . . 1.18 109.044 178.505 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.609 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.4 tt0 -67.77 -42.3 81.92 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.28 -0.873 . . . . 0.8 110.39 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -60.36 -25.62 65.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.034 -0.53 . . . . 1.62 110.618 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.408 HG21 ' CE2' ' A' ' 106' ' ' PHE . 41.4 t -87.31 -50.09 14.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.833 -0.621 . . . . 1.3 111.401 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.609 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.2 p -63.69 -26.85 41.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.444 -0.344 . . . . 0.85 111.107 -179.719 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -67.14 -39.14 86.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.987 0.422 . . . . 0.91 110.535 179.632 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.699 ' HA ' ' HD2' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -89.93 -4.18 57.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.884 -0.598 . . . . 2.87 110.532 179.571 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.723 HD12 HH11 ' A' ' 99' ' ' ARG . 3.7 tp -93.59 9.21 37.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.736 -0.666 . . . . 1.28 111.291 -179.295 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.561 ' HA ' HG22 ' A' ' 95' ' ' VAL . 2.8 p90 -144.44 -28.66 0.49 Allowed 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.692 -0.403 . . . . 2.3 111.937 -179.992 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.699 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -77.8 -22.88 49.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.73 0.3 . . . . 5.06 110.971 -179.514 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.428 ' N ' ' HD3' ' A' ' 92' ' ' ARG . 19.9 t70 -88.92 2.49 53.72 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 3.12 110.62 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 113.66 109.91 2.91 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.855 -0.688 . . . . 2.31 112.389 -179.999 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.561 HG22 ' HA ' ' A' ' 91' ' ' PHE . 42.2 t -79.16 90.22 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.862 0.363 . . . . 1.06 111.01 179.99 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -89.48 178.34 6.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.048 -0.524 . . . . 2.12 110.348 179.653 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 22.1 m-90 -60.55 -60.57 3.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.032 0.444 . . . . 3.34 110.146 179.121 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.618 ' O ' HG22 ' A' ' 101' ' ' VAL . . . -64.45 -26.19 70.58 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.618 -0.719 . . . . 0.69 111.996 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.723 HH11 HD12 ' A' ' 90' ' ' LEU . 13.5 tpp180 -56.06 -36.04 67.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.21 0.528 . . . . 4.24 110.162 179.376 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.569 HG23 HD23 ' A' ' 138' ' ' LEU . 37.9 mt -71.99 -37.67 61.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.445 -0.798 . . . . 0.44 111.198 -179.775 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 98' ' ' GLY . 1.0 OUTLIER -63.23 -29.8 48.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.03 0.443 . . . . 1.35 109.958 179.616 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.19 -28.98 67.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.705 -0.68 . . . . 0.44 109.509 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.503 ' HB2' HD23 ' A' ' 90' ' ' LEU . 86.3 t80 -72.06 -22.27 61.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.97 -1.014 . . . . 1.49 110.207 179.455 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.566 ' CD2' HD21 ' A' ' 50' ' ' LEU . 72.2 m-85 -90.86 -46.02 8.45 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.773 -0.649 . . . . 3.29 111.201 179.765 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.44 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 19.7 p -62.01 -40.65 96.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.937 -0.574 . . . . 1.19 110.665 -179.954 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 106' ' ' PHE . . . . . 0.457 ' HZ ' HD11 ' A' ' 72' ' ' LEU . 15.9 t80 -80.25 -41.91 24.19 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.18 -0.463 . . . . 2.89 110.591 179.864 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.91 -43.76 98.95 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.451 -0.88 . . . . 0.3 111.12 178.982 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 108' ' ' GLY . . . . . 0.654 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -70.67 -28.65 70.57 Favored Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 110.591 -1.004 . . . . 0.23 110.591 178.449 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.534 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -70.55 -30.84 67.67 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.256 -0.646 . . . . 0.31 109.256 178.338 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.506 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -65.3 -33.74 76.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.446 -0.797 . . . . 1.12 108.896 178.851 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.504 ' SG ' HG13 ' A' ' 123' ' ' VAL . 3.2 t -68.12 -38.49 82.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.184 -0.916 . . . . 0.26 109.955 178.906 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 112' ' ' VAL . . . . . 0.541 HG21 ' HG3' ' A' ' 16' ' ' LYS . 74.7 t -70.1 -39.23 76.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.725 -0.67 . . . . 0.35 110.534 179.339 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.535 ' HB3' HG13 ' A' ' 74' ' ' ILE . 31.0 mt-10 -67.65 -21.15 65.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.038 -0.528 . . . . 2.51 109.948 179.454 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 114' ' ' SER . . . . . 0.469 ' HB3' ' HB2' ' A' ' 122' ' ' LEU . 74.9 m -77.23 -50.16 13.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.677 -0.692 . . . . 0.28 109.867 179.07 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.536 HG23 ' HG3' ' A' ' 120' ' ' GLN . 3.4 p -66.65 -21.82 29.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.059 -0.519 . . . . 1.23 109.983 179.001 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -63.63 -37.85 88.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.64 -0.709 . . . . 0.6 110.492 179.477 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -93.69 22.29 5.64 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.992 -0.549 . . . . 1.62 110.716 179.898 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 67.77 22.32 8.9 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.205 -0.452 . . . . 1.88 110.936 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 119' ' ' MET . . . . . 0.495 ' SD ' ' HD3' ' A' ' 76' ' ' PRO . 10.4 mtm -114.77 78.01 1.12 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.251 -0.431 . . . . 0.31 110.506 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.536 ' HG3' HG23 ' A' ' 115' ' ' VAL . 13.9 mp0 -84.59 -3.5 58.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.474 -0.33 . . . . 1.15 111.668 -179.219 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.691 HG23 HD22 ' A' ' 122' ' ' LEU . 25.4 m -72.61 -5.91 7.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.855 0.36 . . . . 0.46 110.914 179.87 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.702 HD11 ' H ' ' A' ' 77' ' ' GLY . 4.1 mm? -93.09 -16.87 24.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.043 -0.526 . . . . 0.26 110.063 179.123 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.504 HG13 ' SG ' ' A' ' 111' ' ' CYS . 94.3 t -52.72 -59.08 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.786 -0.643 . . . . 0.25 111.074 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 124' ' ' SER . . . . . 0.539 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 37.5 t -65.83 -36.76 84.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.032 -0.531 . . . . 1.35 111.449 -179.692 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 125' ' ' ARG . . . . . 0.619 ' HD2' HD13 ' A' ' 122' ' ' LEU . 94.4 mtt180 -60.74 -67.12 0.43 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.507 -0.315 . . . . 2.67 111.248 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 126' ' ' ILE . . . . . 0.506 HD13 ' HB3' ' A' ' 110' ' ' LEU . 74.6 mt -44.82 -42.68 2.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.044 -0.525 . . . . 0.23 111.489 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.587 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.62 -42.52 78.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.416 -0.357 . . . . 0.29 111.057 179.855 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.519 ' HA ' ' NH1' ' A' ' 6' ' ' ARG . . . -69.13 -41.47 77.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.031 -0.531 . . . . 0.28 111.376 -179.963 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -64.31 -39.36 93.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.325 -0.398 . . . . 3.91 111.32 -179.778 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.422 ' HE2' HG13 ' A' ' 9' ' ' VAL . 89.2 mtp -65.16 -52.83 52.65 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.19 -0.459 . . . . 1.08 111.083 -179.574 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -57.8 -53.91 52.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.277 -0.419 . . . . 0.25 110.749 179.788 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.8 m -54.22 -49.73 68.76 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.052 -0.522 . . . . 0.4 111.066 179.869 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -57.03 -30.78 64.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.151 0.5 . . . . 3.13 110.052 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.619 ' O ' HD23 ' A' ' 134' ' ' LEU . 3.6 tt -81.28 -23.2 38.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.55 -0.75 . . . . 0.95 110.119 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -83.06 -6.91 59.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 0.46 112.06 -179.525 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -126.99 -30.47 2.71 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.126 0.787 . . . . 0.59 113.126 -178.148 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 8.3 m80 -107.54 -52.36 2.77 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.29 0.848 . . . . 1.45 113.29 -178.124 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.569 HD23 HG23 ' A' ' 100' ' ' ILE . 10.1 mp -80.84 -37.24 30.33 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.858 1.059 . . . . 1.2 113.858 -177.102 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.453 ' N ' ' HD2' ' A' ' 140' ' ' PRO . 34.8 tt0 -48.73 -53.84 32.88 Favored Pre-proline 0 N--CA 1.468 0.453 0 N-CA-C 112.407 0.521 . . . . 0.75 112.407 -178.073 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 140' ' ' PRO . . . . . 0.463 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 37.2 Cg_endo -65.6 -28.58 52.81 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.733 1.622 . . . . 0.56 112.272 -179.623 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 141' ' ' TRP . . . . . 0.444 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 1.2 t-105 -78.57 -30.01 46.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 1.2 111.155 -179.612 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 142' ' ' ILE . . . . . 0.681 HG22 ' HA2' ' A' ' 147' ' ' GLY . 60.5 mt -69.83 -40.22 78.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.969 -0.559 . . . . 0.32 110.656 -179.706 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 79.0 mm-40 -63.08 -28.68 70.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.519 . . . . 0.57 110.114 179.322 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 16.5 mm-40 -69.62 -23.8 63.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.847 -0.615 . . . . 0.78 110.235 179.301 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -97.51 -1.37 44.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.712 -0.676 . . . . 0.93 110.718 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.14 -35.91 3.61 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.869 -0.682 . . . . 0.56 112.812 179.758 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 147' ' ' GLY . . . . . 0.681 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 117.15 167.31 14.39 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.806 -0.711 . . . . 0.49 112.155 -179.741 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 148' ' ' TRP . . . . . 0.562 ' NE1' HD13 ' A' ' 142' ' ' ILE . 10.7 m-90 -57.76 -38.24 75.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.061 0.458 . . . . 3.57 110.176 179.459 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.445 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 32.5 t70 -60.34 -27.38 67.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.634 -0.712 . . . . 1.96 110.449 179.867 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 25.2 m -83.37 -25.38 31.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.273 0.558 . . . . 0.67 109.912 178.996 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -68.48 -35.2 77.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.481 -0.781 . . . . 3.0 110.383 179.547 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 152' ' ' VAL . . . . . 0.452 HG21 ' HB1' ' A' ' 45' ' ' ALA . 12.2 p -78.79 -2.17 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.436 0.636 . . . . 1.15 110.114 179.265 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 153' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 15.8 mm-40 -91.69 -18.02 24.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.809 -0.632 . . . . 1.67 109.7 178.657 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 22.7 mt -106.58 -52.88 2.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.488 -0.778 . . . . 1.3 110.393 179.714 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -109.0 27.82 9.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.577 -0.738 . . . . 4.24 110.943 -179.824 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 156' ' ' GLY . . . . . 0.439 ' HA2' HG23 ' A' ' 152' ' ' VAL . . . -46.78 152.46 1.32 Allowed Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.909 -0.587 . . . . 1.1 113.683 -179.324 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 157' ' ' ASN . . . . . 0.495 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 5.8 t30 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 115.624 -0.288 . . . . 1.29 110.661 179.719 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1005 ' ' GLY . . . . . 0.684 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.521 0.463 0 N-CA-C 112.858 -0.097 . . . . 1.2 112.858 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -110.11 -40.61 4.67 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.835 0.35 . . . . 2.88 111.188 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -56.95 -76.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.008 -0.542 . . . . 1.31 112.22 -179.197 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1008 ' ' LEU . . . . . 0.546 HD22 ' H ' ' B' 1008 ' ' LEU . 3.3 mm? -50.99 -35.2 32.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 1.33 111.846 -178.875 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B 1009 ' ' ALA . . . . . 0.624 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -62.8 -38.87 92.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.121 0.486 . . . . 0.88 110.977 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -79.95 -52.64 7.59 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.577 -0.738 . . . . 1.03 111.704 -179.306 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -60.31 -25.42 65.76 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.805 0.336 . . . . 1.67 110.763 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.88 9.15 12.01 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 121.007 -0.616 . . . . 0.78 112.787 -179.829 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 20.7 t70 -105.16 -5.15 20.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.988 0.423 . . . . 1.9 110.405 179.748 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 5.1 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 115.862 -0.608 . . . . 1.44 111.239 -179.585 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.9 tpt . . . . . 0 N--CA 1.481 1.098 0 CA-C-O 120.714 0.293 . . . . 6.21 110.857 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.6 m -132.67 -59.81 0.89 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.515 -0.311 . . . . 1.87 110.787 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 37' ' ' ALA . 24.1 mp0 -70.19 1.1 5.14 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.137 0.421 . . . . 2.42 112.137 -177.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.2 m -65.17 -18.05 64.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.833 0.349 . . . . 1.25 110.815 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.597 ' HB2' HD13 ' A' ' 134' ' ' LEU . 4.9 p30 -59.0 -27.25 65.25 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.055 -0.521 . . . . 1.78 111.01 173.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.586 ' O ' HG23 ' A' ' 10' ' ' VAL . 8.7 tpp85 -58.93 -47.76 83.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.814 -0.63 . . . . 1.4 110.278 177.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.566 ' OE1' ' HA2' ' A' ' 40' ' ' GLY . 44.9 mt-10 -54.46 -47.71 72.6 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 115.316 -0.857 . . . . 0.68 110.867 -179.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.437 HD22 HG22 ' A' ' 46' ' ' VAL . 6.2 mt -57.77 -40.16 79.14 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.5 -1.227 . . . . 1.16 109.814 -173.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.4 t -67.53 -59.68 3.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.552 -0.749 . . . . 0.27 110.196 174.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 6' ' ' ARG . 63.4 t -53.6 -50.86 47.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.117 -0.947 . . . . 0.33 112.633 -174.389 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.6 -37.21 70.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.872 0.367 . . . . 0.59 110.876 -176.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.706 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 35.3 t80 -73.6 -47.18 42.31 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 116.297 -0.41 . . . . 1.61 110.793 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.877 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.7 mp -59.13 -38.04 78.67 Favored 'General case' 0 C--O 1.228 -0.075 0 C-N-CA 120.249 -0.58 . . . . 0.34 109.797 178.568 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.448 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 26.3 m -55.27 -50.42 69.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 1.05 110.853 175.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -64.62 -32.06 73.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.003 -0.544 . . . . 1.22 110.461 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.625 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 7.6 mmpt? -63.94 -43.99 94.21 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 115.974 -0.557 . . . . 1.41 111.353 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.657 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.4 OUTLIER -71.55 -30.2 65.61 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 120.178 -0.609 . . . . 1.35 110.079 178.633 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.6 t -60.81 -40.23 91.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.638 -0.71 . . . . 0.94 111.24 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -78.91 0.3 27.9 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.959 0.409 . . . . 1.37 112.014 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.652 ' HE2' HG11 ' A' ' 112' ' ' VAL . 19.0 mmmt -111.6 -27.08 8.71 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.899 0.857 . . . . 2.2 109.123 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.79 20.29 11.87 Favored Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 114.097 -1.411 . . . . 0.53 111.663 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -108.18 167.38 10.05 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.37 -0.604 . . . . 0.76 109.37 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.42 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 3.9 t -110.42 144.42 39.24 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 121.084 0.468 . . . . 0.52 110.359 176.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.448 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.8 OUTLIER -74.44 -48.36 28.0 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.53 -0.759 . . . . 3.36 109.787 175.06 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.471 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 2.5 p -66.19 -31.46 72.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.035 -0.53 . . . . 1.37 111.92 -173.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.42 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 89.9 mt-30 -61.71 -25.33 67.36 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.259 0.552 . . . . 1.11 111.148 177.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -121.35 17.64 11.42 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.559 -0.746 . . . . 1.28 111.058 -176.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.567 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 54.1 p -100.24 -178.13 3.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.484 0.659 . . . . 1.81 112.415 -171.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.615 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 6.7 t70 -171.97 -23.81 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.378 -1.283 . . . . 2.31 109.069 -178.079 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.831 HG23 ' H ' ' A' ' 31' ' ' GLU . 7.1 m -47.17 -70.83 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 114.274 -1.33 . . . . 0.92 112.643 -174.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.831 ' H ' HG23 ' A' ' 30' ' ' VAL . 8.7 pt-20 -100.6 1.16 40.5 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.53 0.681 . . . . 2.74 109.245 175.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.615 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 31.1 tt0 -68.13 -53.88 22.12 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.814 -1.085 . . . . 1.45 110.894 -176.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.2 m-80 -101.17 -28.93 12.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.962 -0.563 . . . . 1.87 111.286 -175.145 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.545 ' O ' ' HA ' ' A' ' 31' ' ' GLU . 15.0 ptp180 -125.39 149.07 48.5 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.683 -0.488 . . . . 3.39 109.683 177.105 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.7 p -104.8 107.95 19.18 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.554 0.693 . . . . 2.25 111.28 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -89.7 -80.51 0.31 Allowed 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.066 -0.97 . . . . 3.34 109.83 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 3' ' ' GLN . . . -102.66 157.32 33.95 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 115.715 -0.675 . . . . 1.92 110.911 177.344 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.779 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 50.2 Cg_exo -58.01 -175.82 0.07 OUTLIER 'Trans proline' 0 CA--C 1.533 0.454 0 C-N-CA 123.401 2.734 . . . . 1.87 113.003 172.155 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -80.11 -10.51 59.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.412 0.625 . . . . 4.64 110.485 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.566 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 166.53 63.24 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.646 -0.706 . . . . 2.15 111.748 178.1 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.81 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.8 OUTLIER -67.78 -75.5 0.1 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 120.724 -0.39 . . . . 1.12 110.488 -175.16 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.81 ' H ' HG23 ' A' ' 41' ' ' THR . 15.2 pt-20 -93.68 -31.94 14.25 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 122.343 1.068 . . . . 2.02 108.935 170.017 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.952 ' HA ' HG13 ' A' ' 46' ' ' VAL . 66.6 m -59.17 -25.91 64.33 Favored 'General case' 0 C--O 1.209 -1.027 0 CA-C-N 113.315 -1.766 . . . . 1.25 113.496 -170.281 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -43.96 -38.89 3.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 118.131 0.423 . . . . 1.91 111.56 -177.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.409 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -86.06 -42.35 14.02 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.567 0.21 . . . . 0.52 111.567 174.488 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.952 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.6 m -68.33 -41.92 83.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 120.908 -0.317 . . . . 1.41 111.796 -175.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.795 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.0 ptpt -68.4 -36.26 78.85 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.154 -0.684 . . . . 0.67 109.154 178.094 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.491 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 24.8 mm-40 -61.16 -36.52 80.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.587 -0.733 . . . . 0.99 111.405 174.064 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.625 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -75.7 -40.66 55.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.673 0.749 . . . . 0.42 110.177 175.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.559 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -56.65 -40.71 75.94 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.722 -1.126 . . . . 1.33 112.113 -178.92 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.544 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 7.5 ptp180 -75.44 -29.89 59.84 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.774 0.797 . . . . 2.17 109.617 -169.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 32.9 mm-40 -72.51 -48.3 41.63 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.283 -1.326 . . . . 1.1 109.852 179.297 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.57 -36.99 85.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.557 -0.747 . . . . 0.53 110.355 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.585 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -61.89 -42.36 99.73 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.912 -0.585 . . . . 0.7 111.782 176.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -58.64 -42.98 89.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.005 0.431 . . . . 1.04 110.517 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -57.41 -28.26 63.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.394 -0.821 . . . . 2.29 111.239 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.496 ' CZ ' HD12 ' B' 1008 ' ' LEU . 17.2 t80 -82.2 -39.4 23.18 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.221 -0.445 . . . . 2.29 110.983 178.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.705 ' HA ' ' CE2' ' A' ' 61' ' ' TYR . 40.2 mt-10 -60.52 -63.69 1.21 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.138 -0.483 . . . . 1.3 112.21 -168.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.636 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -49.64 -37.46 28.35 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 123.673 0.608 . . . . 1.54 112.342 -178.399 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.636 ' H ' HD12 ' A' ' 59' ' ' LEU . 63.6 mtt180 -63.6 -44.54 93.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.172 -0.467 . . . . 2.58 111.728 -177.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.705 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 5.5 p90 -90.95 -7.81 51.03 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 120.654 -0.418 . . . . 5.32 111.506 -179.267 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -58.28 -26.0 62.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 4.48 111.385 -174.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -55.87 -46.26 78.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.046 -0.525 . . . . 4.72 110.937 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.701 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.85 -32.7 15.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.409 -0.36 . . . . 1.17 111.498 -178.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.697 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 47.5 t80 -42.91 -46.92 5.54 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.735 1.013 . . . . 2.81 113.735 -171.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.2 p -68.13 -27.53 66.52 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.92 0.391 . . . . 2.19 111.608 -175.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -90.42 -29.21 18.14 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.023 -0.535 . . . . 2.72 111.552 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 65.1 mt -66.48 -17.77 64.99 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.894 0.702 . . . . 1.56 112.894 -171.172 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.641 HG22 HG13 ' A' ' 74' ' ' ILE . 8.6 p -61.24 -24.77 66.6 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.429 0.633 . . . . 0.7 110.694 -176.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.0 m -74.95 -29.71 61.01 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.847 -1.069 . . . . 1.34 110.501 176.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.429 ' OE1' HD22 ' A' ' 68' ' ' LEU . 50.2 mt-30 -82.0 -49.47 10.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.475 -0.784 . . . . 1.42 110.504 -177.339 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.699 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.7 mp -66.17 -28.77 69.03 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.086 -0.709 . . . . 1.37 109.086 176.127 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 67.9 t60 64.45 55.26 1.39 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 122.244 1.021 . . . . 2.72 108.253 -176.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.641 HG13 HG22 ' A' ' 69' ' ' THR . 15.5 mm -57.42 112.04 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 113.628 -1.624 . . . . 0.91 110.666 -178.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.781 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.5 -167.45 0.16 Allowed Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 107.424 -1.324 . . . . 0.51 107.424 -169.12 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.781 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.0 Cg_exo -29.03 165.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.303 0 C-N-CA 124.636 3.558 . . . . 0.47 115.037 162.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -34.61 -24.63 0.01 OUTLIER Glycine 0 N--CA 1.474 1.208 0 N-CA-C 117.221 1.648 . . . . 0.4 117.221 -171.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 76' ' ' PRO . 40.1 p -69.1 3.37 2.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 117.956 0.878 . . . . 0.56 112.096 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.11 -14.15 62.2 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.274 0.559 . . . . 0.34 109.961 173.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -78.12 -15.82 58.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.567 . . . . 4.13 109.543 176.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.497 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 36.5 mt-30 -87.87 -22.62 24.32 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.801 0.81 . . . . 1.03 109.672 173.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.528 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 5.8 m -72.35 -48.71 39.67 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.617 -1.174 . . . . 0.48 109.293 170.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.5 ' O ' HG13 ' A' ' 86' ' ' VAL . 84.8 t80 -70.69 -15.59 62.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.021 -0.991 . . . . 1.18 110.047 173.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.662 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.1 tt0 -64.7 -49.07 72.35 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.167 0.508 . . . . 0.8 110.276 175.334 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.416 ' H ' ' HG3' ' A' ' 85' ' ' GLN . 64.1 mt-30 -43.07 -44.8 5.02 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.525 -1.216 . . . . 1.62 111.318 178.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.966 ' HA ' ' HA2' ' B' 1005 ' ' GLY . 0.9 OUTLIER -86.15 -44.53 16.74 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.335 0 CA-C-N 113.835 -1.53 . . . . 1.3 111.829 -172.645 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.662 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.8 p -62.23 -23.53 32.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.98 0.895 . . . . 0.85 109.876 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.73 -48.52 74.31 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.357 -1.292 . . . . 0.91 110.917 176.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.714 ' HB3' ' HB2' ' B' 1009 ' ' ALA . 5.6 mm-40 -69.15 -43.56 74.06 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-O 122.443 1.116 . . . . 2.87 108.815 178.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.597 ' HG ' ' NH1' ' A' ' 99' ' ' ARG . 8.4 tp -54.86 -24.98 25.71 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 112.312 -2.222 . . . . 1.28 111.518 -173.312 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.506 ' O ' HG23 ' A' ' 95' ' ' VAL . 76.1 t80 -100.04 -35.67 9.62 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.637 0.732 . . . . 2.3 110.935 -173.06 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.544 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 7.5 ptm180 -77.82 -35.26 51.5 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.502 -0.772 . . . . 5.06 111.42 -172.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -93.22 20.64 6.74 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.411 -0.813 . . . . 3.12 112.753 -169.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.584 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 128.02 68.59 0.14 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 117.167 -2.444 . . . . 2.31 115.935 174.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.569 ' HA ' ' HE ' ' A' ' 99' ' ' ARG . 67.8 t -73.31 98.43 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 118.649 1.225 . . . . 1.06 111.611 177.528 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -112.45 -170.78 1.73 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.327 -1.306 . . . . 2.12 108.996 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.754 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 22.5 m-90 -63.63 -63.54 1.14 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.9 0.381 . . . . 3.34 110.666 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.427 ' O ' HG22 ' A' ' 101' ' ' VAL . . . -67.11 -26.66 73.35 Favored Glycine 0 C--O 1.225 -0.411 0 CA-C-N 115.933 -0.576 . . . . 0.69 112.723 -177.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.598 ' HD2' ' O ' ' A' ' 99' ' ' ARG . 1.7 tmm_? -58.23 -40.16 80.95 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.936 0.398 . . . . 4.24 110.268 178.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 52.6 mt -67.8 -28.18 40.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.522 -0.308 . . . . 0.44 111.656 -175.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.527 HG22 HD13 ' B' 1015 ' ' ILE . 0.8 OUTLIER -64.03 -25.88 39.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.308 0.575 . . . . 1.35 110.079 176.472 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.482 ' HA ' ' CD2' ' A' ' 57' ' ' PHE . . . -66.94 -39.79 87.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.735 0.779 . . . . 0.44 110.327 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.463 ' HB2' HH12 ' A' ' 99' ' ' ARG . 28.0 t80 -64.0 -46.17 85.74 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.366 -1.288 . . . . 1.49 110.914 -178.098 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.595 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.1 OUTLIER -80.36 -18.69 48.29 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.529 -0.468 . . . . 3.29 110.553 -178.283 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.706 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 35.3 t -75.17 -57.5 3.85 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.383 -0.371 . . . . 1.19 110.59 178.369 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -68.3 -24.19 64.82 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 109.498 -0.556 . . . . 2.89 109.498 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.469 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -67.12 -42.3 91.8 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.69 -0.767 . . . . 0.3 111.467 172.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.877 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.82 -31.29 79.28 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.66 -0.781 . . . . 0.23 111.396 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.697 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -75.2 -33.05 61.37 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.69 -0.255 . . . . 0.31 110.553 176.263 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -39.4 83.62 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 107.956 -1.127 . . . . 1.12 107.956 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.771 ' SG ' HG22 ' A' ' 123' ' ' VAL . 29.9 t -49.57 -62.92 1.28 Allowed 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 113.368 -1.742 . . . . 0.26 110.204 172.046 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.887 ' HA ' HG13 ' A' ' 115' ' ' VAL . 46.8 t -63.18 -34.54 67.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.384 -0.371 . . . . 0.35 111.48 -176.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.62 ' HB3' HG21 ' A' ' 74' ' ' ILE . 36.7 mt-10 -55.91 -25.32 42.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.097 0.475 . . . . 2.51 110.418 176.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.44 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 65.0 m -85.0 -41.46 15.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.485 -0.931 . . . . 0.28 108.485 -178.372 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.887 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.4 m -69.14 -29.74 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.349 0 CA-C-N 114.734 -1.121 . . . . 1.23 109.422 -177.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -51.31 -51.03 58.01 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.205 -1.816 . . . . 0.6 111.563 175.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -83.52 10.59 8.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.724 -0.671 . . . . 1.62 109.743 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.613 ' HA ' ' NE2' ' A' ' 120' ' ' GLN . 36.0 mt-10 63.31 55.82 1.79 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 122.159 0.981 . . . . 1.88 109.805 -176.024 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 24.6 mtm -134.96 37.36 3.04 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.848 -1.524 . . . . 0.31 107.553 179.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.702 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 4.9 mp0 -52.28 -7.36 0.06 Allowed 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 114.903 -1.044 . . . . 1.15 113.353 -178.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.447 HG23 HD22 ' A' ' 122' ' ' LEU . 27.0 m -67.41 -22.41 28.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 121.464 -0.773 . . . . 0.46 111.921 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.715 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.5 mm? -71.6 -24.77 61.95 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.014 0.435 . . . . 0.26 109.928 178.061 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.771 HG22 ' SG ' ' A' ' 111' ' ' CYS . 42.3 t -44.92 -49.38 2.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 114.716 -1.129 . . . . 0.25 112.593 -177.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.567 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 8.9 t -78.22 -34.83 49.07 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.44 -0.504 . . . . 1.35 110.58 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.715 ' HD2' HD13 ' A' ' 122' ' ' LEU . 66.5 mtt180 -62.85 -49.27 75.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.002 -0.545 . . . . 2.67 110.418 -176.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.547 HD12 ' HA ' ' A' ' 111' ' ' CYS . 73.6 mt -57.82 -52.19 60.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.488 -0.778 . . . . 0.23 110.767 178.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.748 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -54.07 -36.68 63.4 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 123.291 0.37 . . . . 0.29 111.339 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.46 -56.13 23.54 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.357 0.599 . . . . 0.28 111.054 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -72.57 -23.7 61.0 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.225 -0.898 . . . . 3.91 111.627 -174.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.545 ' SD ' HG22 ' A' ' 126' ' ' ILE . 88.8 mtp -66.01 -58.72 4.87 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.1 0.476 . . . . 1.08 110.343 174.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.96 -35.65 79.09 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.704 -0.68 . . . . 0.25 110.702 -178.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.6 m -63.47 -46.7 84.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.411 -0.359 . . . . 0.4 110.95 176.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -56.69 -39.12 73.25 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.858 -0.423 . . . . 3.13 109.858 177.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.949 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.9 tt -62.77 -50.98 68.9 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.985 -0.746 . . . . 0.95 108.985 174.198 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -51.46 -49.54 61.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.673 0.62 . . . . 0.46 112.673 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -83.15 -51.29 7.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.041 0.448 . . . . 0.59 112.103 -176.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -91.4 -50.46 5.79 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 113.121 0.786 . . . . 1.45 113.121 -170.293 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.949 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -80.61 -45.05 17.93 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.564 0.95 . . . . 1.2 113.564 -168.323 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.605 ' HA ' HD12 ' A' ' 142' ' ' ILE . 28.1 tt0 -47.47 -50.4 49.82 Favored Pre-proline 0 C--N 1.322 -0.612 0 O-C-N 123.686 0.616 . . . . 0.75 112.526 -175.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.576 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 51.8 Cg_exo -52.99 -50.26 14.69 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 121.746 1.63 . . . . 0.56 111.734 176.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -58.83 -48.16 82.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.587 -0.733 . . . . 1.2 110.513 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.605 HD12 ' HA ' ' A' ' 139' ' ' GLU . 43.9 mt -49.92 -50.96 17.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.058 -0.519 . . . . 0.32 111.351 176.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.58 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 79.2 mm-40 -60.21 -31.45 70.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.559 -0.746 . . . . 0.57 111.587 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.7 mm-40 -65.41 -20.71 66.49 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 121.519 0.676 . . . . 0.78 110.685 177.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ASN . . . . . 0.414 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 18.1 m-80 -111.47 5.84 19.83 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.088 -0.96 . . . . 0.93 110.371 -174.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.01 -47.08 1.06 Allowed Glycine 0 N--CA 1.441 -1.006 0 CA-C-N 115.318 -0.855 . . . . 0.56 113.294 173.228 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' GLY . . . . . 0.559 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 130.16 -172.39 20.24 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.48 -0.867 . . . . 0.49 112.064 -177.569 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 9.0 m-90 -76.08 -35.5 59.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.529 0.204 . . . . 3.57 110.742 -177.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -59.1 -43.94 91.91 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.176 0.512 . . . . 1.96 109.702 175.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.593 ' O ' HD13 ' A' ' 154' ' ' LEU . 95.8 m -60.1 -34.48 73.54 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.29 -0.868 . . . . 0.67 111.021 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.754 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 90.0 t80 -60.68 -41.44 95.09 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.482 -0.487 . . . . 3.0 110.212 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.512 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.5 m -76.03 -26.94 17.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.916 0.389 . . . . 1.15 110.486 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' A' ' 150' ' ' THR . 7.8 mm-40 -56.0 -47.95 76.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.342 0.592 . . . . 1.67 109.56 170.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.593 HD13 ' O ' ' A' ' 150' ' ' THR . 7.4 mp -78.25 -61.25 2.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.2 -0.909 . . . . 1.3 112.902 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -120.83 29.64 7.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.303 0.573 . . . . 4.24 110.423 -168.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.625 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -58.92 166.19 7.89 Favored Glycine 0 CA--C 1.506 -0.473 0 CA-C-N 115.476 -0.784 . . . . 1.1 114.115 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -56.37 110.07 0.71 Allowed 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 113.835 -1.182 . . . . 1.29 111.038 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.561 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 10.9 t-20 -81.86 -16.56 50.33 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 116.31 -0.404 . . . . 2.99 110.378 -174.161 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.01 -51.68 69.02 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.656 -0.498 . . . . 2.52 109.656 172.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -67.15 -32.51 73.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.631 -0.713 . . . . 2.87 110.243 175.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.561 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -57.46 -52.05 66.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.709 -0.678 . . . . 3.2 110.49 176.132 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 158' ' ' ASN . 42.4 mt-10 -67.92 -31.5 71.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.249 -0.432 . . . . 3.72 110.732 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 36.2 t -58.1 -46.34 85.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.063 -0.517 . . . . 4.18 110.624 178.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -87.21 -16.01 36.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.915 0.388 . . . . 5.82 111.402 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -67.32 -29.67 69.31 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.836 -0.62 . . . . 4.77 110.613 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -55.68 -56.71 22.36 Favored Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 115.913 -0.585 . . . . 5.1 112.518 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -75.6 -23.75 56.49 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.927 0.394 . . . . 5.72 111.012 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -72.96 -12.26 60.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.019 0.438 . . . . 5.88 109.917 179.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.619 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 0.1 OUTLIER -72.67 -31.46 65.08 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.74 -0.837 . . . . 7.34 108.74 179.137 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -84.74 -12.46 53.69 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.249 -0.887 . . . . 6.97 109.803 176.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 171' ' ' GLU . . . . . 0.64 ' HB3' ' CD2' ' A' ' 173' ' ' HIS . 46.2 mt-10 65.87 104.81 0.04 OUTLIER 'General case' 0 C--O 1.23 0.076 0 CA-C-N 115.116 -0.947 . . . . 6.97 110.779 -177.199 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -82.08 -38.2 25.25 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.472 -0.491 . . . . 9.35 110.692 -177.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' HIS . . . . . 0.64 ' CD2' ' HB3' ' A' ' 171' ' ' GLU . 91.3 m-70 48.19 -157.84 0.06 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.442 -0.345 . . . . 11.4 111.494 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 64.5 m80 64.47 21.41 12.45 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.058 -0.519 . . . . 11.52 111.183 174.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -115.22 105.07 12.47 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.211 -0.449 . . . . 14.48 110.702 -177.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -106.54 157.09 17.93 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.474 -0.565 . . . . 15.37 109.474 177.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 49.5 p-80 -130.14 128.25 41.41 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.271 0.557 . . . . 16.02 111.331 -177.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 78.3 mt -106.33 -1.35 23.47 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.036 -0.728 . . . . 17.99 109.036 174.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -83.35 148.98 27.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.114 -0.948 . . . . 19.19 110.364 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 32.0 m80 -127.67 96.91 4.67 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.321 -0.4 . . . . 22.26 110.961 178.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 59.0 m80 65.76 -174.92 0.18 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.771 -0.649 . . . . 22.51 111.912 177.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -89.17 122.24 32.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.563 -0.744 . . . . 24.89 109.311 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -93.22 155.64 17.32 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.767 0.317 . . . . 25.58 110.66 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 48.1 p-80 -124.63 173.71 8.34 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.125 -0.489 . . . . 27.37 110.29 -178.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 11.1 p80 . . . . . 0 C--O 1.247 0.965 0 CA-C-N 116.315 -0.402 . . . . 29.06 110.354 178.751 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.263 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . 116.57 163.58 13.36 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 121.006 -0.616 . . . . 2.97 112.004 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.594 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . 16.4 m 65.1 -140.32 0.22 Allowed 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 122.375 0.27 . . . . 1.94 110.848 178.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.526 ' HA ' HD22 ' B' 1008 ' ' LEU . 2.9 m 40.86 -79.3 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.345 0.374 0 C-N-CA 125.4 1.48 . . . . 1.63 114.442 175.221 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B 1005 ' ' GLY . . . . . 0.966 ' HA2' ' HA ' ' A' ' 86' ' ' VAL . . . -43.51 -62.19 2.59 Favored Glycine 0 N--CA 1.435 -1.405 0 C-N-CA 119.163 -1.494 . . . . 1.2 110.287 168.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -61.08 -42.16 97.99 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.932 0.345 . . . . 2.88 111.932 177.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -70.91 -49.5 45.1 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.342 0.497 . . . . 1.31 112.342 -171.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.722 ' HB2' HG23 ' A' ' 86' ' ' VAL . 2.1 mm? -73.82 -34.93 64.78 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.055 -0.258 . . . . 1.33 110.425 -178.361 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B 1009 ' ' ALA . . . . . 0.714 ' HB2' ' HB3' ' A' ' 89' ' ' GLU . . . -47.22 -47.52 24.47 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.983 0.897 . . . . 0.88 110.377 168.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.794 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -79.82 -58.42 3.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 114.026 -1.443 . . . . 1.03 111.881 -174.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.535 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 37.5 m-85 -61.65 -19.21 62.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 1.67 111.15 -178.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.92 -25.08 72.52 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 121.033 -0.603 . . . . 0.78 113.106 -178.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 31.1 t70 -77.05 5.83 7.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.411 0.624 . . . . 1.9 110.513 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 35.3 m -101.5 4.62 41.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.028 -0.533 . . . . 1.44 111.092 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.527 HD13 HG22 ' A' ' 101' ' ' VAL . 55.4 mt -79.85 67.41 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 121.903 0.859 . . . . 2.91 110.045 178.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 36.4 t-20 -178.26 -51.62 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.431 -1.259 . . . . 4.29 107.66 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -134.84 98.67 4.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.971 -1.013 . . . . 8.17 110.059 175.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.66 0 CA-C-N 116.427 -0.351 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.794 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.3 mmt . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 109.667 -0.494 . . . . 6.21 109.667 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.59 ' HB3' ' OD1' ' A' ' 135' ' ' ASN . 74.1 m -107.32 -37.12 6.33 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.001 0.429 . . . . 1.87 111.369 179.009 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.438 ' O ' ' HB3' ' A' ' 6' ' ' ARG . 24.3 mp0 -70.74 -15.23 62.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.021 0.439 . . . . 2.42 110.651 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.528 ' O ' ' HG ' ' A' ' 8' ' ' LEU . 5.1 p -68.7 -32.2 71.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.095 -0.502 . . . . 1.25 111.176 178.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.823 ' HB3' HD13 ' A' ' 134' ' ' LEU . 50.6 m-20 -62.15 -26.66 68.45 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.077 0.465 . . . . 1.78 110.127 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.567 ' O ' HG23 ' A' ' 10' ' ' VAL . 16.9 tpp85 -57.47 -49.36 76.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.491 -0.777 . . . . 1.4 109.81 176.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.645 ' HG3' ' HB1' ' A' ' 37' ' ' ALA . 45.0 mt-10 -57.23 -44.99 84.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.528 -0.76 . . . . 0.68 111.085 178.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.557 HD22 HG22 ' A' ' 46' ' ' VAL . 8.8 mt -60.65 -29.39 69.24 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.583 -1.189 . . . . 1.16 110.117 -174.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.551 HG21 ' N ' ' A' ' 131' ' ' ALA . 55.9 t -80.65 -59.62 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 115.05 -0.977 . . . . 0.27 110.161 173.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 6' ' ' ARG . 99.4 t -52.28 -54.59 13.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.38 -0.827 . . . . 0.33 112.466 -175.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -56.85 -35.86 69.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.996 0.427 . . . . 0.59 110.355 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.532 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 8.2 t80 -72.38 -48.0 45.03 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.84 -0.618 . . . . 1.61 110.469 -178.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.85 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.5 mp -61.66 -42.21 98.6 Favored 'General case' 0 C--N 1.338 0.098 0 C-N-CA 120.793 -0.363 . . . . 0.34 110.516 177.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.8 t -58.97 -45.52 90.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.12 -0.491 . . . . 1.05 110.142 177.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -59.37 -33.83 71.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.469 -0.787 . . . . 1.22 110.936 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.712 ' HE2' ' HA ' ' A' ' 16' ' ' LYS . 8.6 mmpt? -75.96 -30.96 58.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.379 -0.373 . . . . 1.41 111.932 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.552 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -70.25 -27.78 64.71 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.261 -0.576 . . . . 1.35 110.265 176.511 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -58.8 -43.41 90.54 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.879 -0.601 . . . . 0.94 112.315 -178.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -72.45 -2.75 20.68 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.28 0.562 . . . . 1.37 111.551 -177.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.603 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 18.3 mmmt -109.64 -26.25 9.99 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.945 0.879 . . . . 2.2 109.014 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.14 22.1 11.04 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 113.829 -1.532 . . . . 0.53 111.171 178.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.603 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 95.1 m-85 -114.17 165.52 12.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.942 0.401 . . . . 0.76 110.827 -179.036 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.8 t -110.92 141.33 44.48 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.758 -0.656 . . . . 0.52 109.906 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -65.72 -46.12 80.13 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.113 -0.494 . . . . 3.36 110.01 174.069 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.3 p -64.75 -36.52 84.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.748 -0.66 . . . . 1.37 111.836 -172.065 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.69 -31.01 69.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.073 0.463 . . . . 1.11 111.24 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.502 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 15.8 m-85 -112.54 13.54 20.08 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.892 -0.594 . . . . 1.28 110.441 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.568 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 79.8 p -96.76 -179.29 4.53 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 121.69 0.757 . . . . 1.81 111.511 -176.351 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.496 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.2 t70 -164.86 -26.06 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.98 -1.464 . . . . 2.31 107.753 -177.389 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.938 HG23 ' H ' ' A' ' 31' ' ' GLU . 8.9 m -59.81 -75.11 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 113.734 -1.575 . . . . 0.92 112.331 -177.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.938 ' H ' HG23 ' A' ' 30' ' ' VAL . 12.3 mm-40 -80.72 -7.87 59.49 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.618 -0.882 . . . . 2.74 108.618 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 25.2 tt0 -66.11 -44.94 82.86 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.174 -1.376 . . . . 1.45 110.528 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -102.74 -49.72 3.74 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.944 -0.571 . . . . 1.87 111.917 -175.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.494 ' HG2' ' O ' ' A' ' 30' ' ' VAL . 12.7 ptp180 -94.76 155.28 16.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.925 0.393 . . . . 3.39 110.74 -178.017 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 31.9 p -125.44 115.02 19.6 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.996 -0.547 . . . . 2.25 110.365 176.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -137.15 -69.27 0.46 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.61 -0.723 . . . . 3.34 110.461 -178.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.645 ' HB1' ' HG3' ' A' ' 7' ' ' GLU . . . -60.07 133.33 90.07 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 115.244 -0.889 . . . . 1.92 111.86 -179.392 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.76 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 17.4 Cg_exo -68.3 -171.54 0.37 Allowed 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 124.032 3.155 . . . . 1.87 112.005 176.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -90.57 13.06 16.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.484 0.659 . . . . 4.64 110.397 177.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 134.4 66.19 0.07 OUTLIER Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.347 -0.842 . . . . 2.15 111.225 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.825 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.3 t -69.09 -76.97 0.09 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 120.756 -0.378 . . . . 1.12 110.725 -174.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.825 ' H ' HG23 ' A' ' 41' ' ' THR . 15.9 pt-20 -95.56 -26.5 15.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.589 1.185 . . . . 2.02 108.762 167.309 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.774 ' HB2' ' HE3' ' A' ' 47' ' ' LYS . 1.4 p -55.78 -39.67 71.57 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 112.407 -2.179 . . . . 1.25 114.56 -169.229 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -39.66 -53.74 2.13 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.895 0.747 . . . . 1.91 112.792 -169.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.15 -36.24 58.86 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.94 0.348 . . . . 0.52 111.94 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.622 ' HB ' ' HB3' ' A' ' 148' ' ' TRP . 0.8 OUTLIER -69.98 -44.88 78.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 121.012 -0.275 . . . . 1.41 110.888 -176.787 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.774 ' HE3' ' HB2' ' A' ' 43' ' ' SER . 18.1 ptpt -64.16 -41.28 97.22 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.422 -0.584 . . . . 0.67 109.422 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.508 ' OE1' ' HD2' ' A' ' 51' ' ' ARG . 6.3 mm-40 -56.89 -34.93 68.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.357 -0.838 . . . . 0.99 111.545 174.296 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.714 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -78.61 -33.86 47.11 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.234 0.54 . . . . 0.42 110.501 178.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 12.5 mt -63.38 -33.66 76.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.484 -0.78 . . . . 1.33 112.306 -177.165 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.508 ' HD2' ' OE1' ' A' ' 48' ' ' GLN . 8.3 ptp180 -79.49 -29.25 41.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.592 0.71 . . . . 2.17 109.178 -174.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -70.27 -43.78 69.77 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.29 -1.323 . . . . 1.1 110.655 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.28 -43.68 69.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.823 -0.626 . . . . 0.53 110.526 176.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.633 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.66 -39.09 96.1 Favored Glycine 0 C--O 1.226 -0.346 0 CA-C-N 115.852 -0.613 . . . . 0.7 111.815 178.069 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -53.59 -43.58 68.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.024 0.44 . . . . 1.04 110.463 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.675 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 37.5 mt-10 -69.97 -38.4 76.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.891 -0.595 . . . . 2.29 111.268 177.6 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.515 ' HE2' ' CZ ' ' A' ' 106' ' ' PHE . 7.3 t80 -65.16 -33.0 74.98 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.363 -0.381 . . . . 2.29 110.773 -174.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.633 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 33.6 mt-10 -65.35 -47.14 77.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.16 -0.473 . . . . 1.3 110.793 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' A' ' 56' ' ' GLU . 4.6 pp -68.67 -31.26 70.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 1.54 110.638 -179.28 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.705 ' HB3' ' SG ' ' B' 1014 ' ' CYS . 47.3 mtt180 -68.77 -35.94 77.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.586 0.708 . . . . 2.58 110.186 178.403 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.704 ' HB3' ' HB3' ' A' ' 65' ' ' PHE . 0.2 OUTLIER -91.5 0.04 57.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.925 -1.034 . . . . 5.32 112.089 -177.718 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -35.81 -39.44 0.15 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.125 1.158 . . . . 4.48 114.125 -172.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.5 ' NH1' ' O71' ' B' 1100 ' ' 33B . 34.6 ttm180 -75.46 -42.98 51.9 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 122.181 -0.324 . . . . 4.72 111.7 -175.289 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.52 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -91.91 -41.19 10.73 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.786 0.661 . . . . 1.17 112.786 -174.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.704 ' HB3' ' HB3' ' A' ' 61' ' ' TYR . 5.5 p90 -49.49 -40.71 38.39 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.524 0.935 . . . . 2.81 113.524 -164.12 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.5 t -91.03 -42.36 10.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.934 0.397 . . . . 2.19 110.39 -177.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -59.2 -28.64 66.83 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.619 0.723 . . . . 2.72 110.955 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.635 ' O ' HD12 ' A' ' 72' ' ' LEU . 1.8 mp -62.42 -17.06 58.41 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.029 -0.987 . . . . 1.56 113.263 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.698 HG22 HG13 ' A' ' 74' ' ' ILE . 12.6 p -62.65 -22.9 66.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 118.397 0.544 . . . . 0.7 112.058 -175.438 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.7 t -76.15 -35.14 59.35 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.017 -0.735 . . . . 1.34 109.017 174.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.501 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 36.8 mt-30 -69.2 -47.41 64.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.816 -1.084 . . . . 1.42 109.785 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.635 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mt -70.53 -32.02 69.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.602 -0.726 . . . . 1.37 110.109 177.269 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 60.74 63.95 1.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.999 0.904 . . . . 2.72 108.861 -172.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.761 HG21 ' HB3' ' A' ' 113' ' ' GLU . 29.3 mm -60.64 115.05 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 114.006 -1.452 . . . . 0.91 111.382 -178.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.773 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -155.58 -172.26 0.31 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 107.963 -1.125 . . . . 0.51 107.963 -171.463 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.773 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 17.8 Cg_exo -31.05 167.36 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.327 0 C-N-CA 125.029 3.819 . . . . 0.47 115.091 165.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.501 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.85 -27.16 0.01 OUTLIER Glycine 0 N--CA 1.476 1.331 0 N-CA-C 117.372 1.709 . . . . 0.4 117.372 -174.176 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.458 ' N ' ' O ' ' A' ' 76' ' ' PRO . 24.9 p -68.48 -0.36 4.92 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 117.909 0.855 . . . . 0.56 111.925 177.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.32 -14.75 62.72 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.295 0.569 . . . . 0.34 109.621 170.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -73.33 -25.99 60.85 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.577 -0.738 . . . . 4.13 109.553 173.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.448 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 78.2 mt-30 -80.71 -31.98 35.94 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.902 0.858 . . . . 1.03 109.092 177.402 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.3 m -63.62 -54.21 39.43 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.015 -1.448 . . . . 0.48 110.005 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.47 ' HA ' HG23 ' A' ' 86' ' ' VAL . 79.7 t80 -70.41 -18.49 63.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.365 -0.834 . . . . 1.18 110.717 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.608 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.6 tt0 -59.21 -50.25 74.76 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.692 -0.686 . . . . 0.8 110.46 176.491 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.554 ' OE1' HG21 ' B' 1004 ' ' VAL . 80.5 mt-30 -47.62 -32.45 5.57 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.596 -1.184 . . . . 1.62 110.769 175.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.998 HG13 ' HG ' ' B' 1008 ' ' LEU . 1.6 t -84.1 -54.7 8.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-N 114.552 -1.203 . . . . 1.3 110.879 -176.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.608 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.3 p -60.69 -29.65 45.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.83 -0.623 . . . . 0.85 109.989 -176.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.734 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 0.7 OUTLIER -58.22 -50.09 74.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.758 -1.11 . . . . 0.91 110.687 175.929 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 1.002 ' HB3' ' HB2' ' B' 1009 ' ' ALA . 35.7 mm-40 -64.26 -42.79 96.32 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 122.331 1.062 . . . . 2.87 109.391 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.489 ' HA ' HD12 ' A' ' 90' ' ' LEU . 0.3 OUTLIER -58.14 -25.48 61.49 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 112.692 -2.049 . . . . 1.28 112.814 -165.906 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.597 ' HA ' HG22 ' A' ' 95' ' ' VAL . 15.9 p90 -106.28 -22.15 12.91 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.62 -0.432 . . . . 2.3 112.071 -174.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.734 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.7 OUTLIER -94.24 -29.59 15.01 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-O 121.257 0.551 . . . . 5.06 111.298 -175.557 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.561 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 37.6 t70 -90.31 7.48 38.19 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.637 -0.71 . . . . 3.12 112.685 -168.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 129.59 70.63 0.12 Allowed Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 117.125 -2.464 . . . . 2.31 114.345 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.597 HG22 ' HA ' ' A' ' 91' ' ' PHE . 48.6 t -71.65 101.52 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 122.399 1.095 . . . . 1.06 111.302 -179.462 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.475 ' H ' ' CB ' ' A' ' 99' ' ' ARG . 1.1 m-20 -111.47 -179.87 3.83 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 113.745 -1.57 . . . . 2.12 108.293 177.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.573 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 5.1 m95 -60.93 -52.43 65.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.81 0.338 . . . . 3.34 111.002 177.146 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.474 ' HA3' HG23 ' B' 1015 ' ' ILE . . . -69.88 -20.0 75.69 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.926 -0.654 . . . . 0.69 112.697 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.475 ' CB ' ' H ' ' A' ' 96' ' ' ASN . 4.7 tpp180 -67.24 -40.61 86.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.404 0.621 . . . . 4.24 110.015 179.496 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.533 HG22 ' CE2' ' A' ' 104' ' ' PHE . 69.8 mt -72.17 -39.39 64.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.407 -0.815 . . . . 0.44 110.125 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 97' ' ' TRP . 55.2 t -53.44 -46.99 59.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.837 -0.619 . . . . 1.35 110.233 172.278 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 99' ' ' ARG . . . -49.31 -51.71 32.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.179 -0.918 . . . . 0.44 110.888 174.666 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -54.63 -44.52 73.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.252 -0.886 . . . . 1.49 110.961 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.562 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 57.3 m-85 -64.77 -43.27 93.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.646 0.26 . . . . 3.29 111.146 176.033 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.515 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 27.3 m -60.9 -49.97 75.31 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.181 -0.463 . . . . 1.19 110.864 -177.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.515 ' CZ ' ' HE2' ' A' ' 57' ' ' PHE . 33.0 m-85 -72.23 -33.63 67.7 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.399 -0.364 . . . . 2.89 110.875 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.706 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -69.07 -41.63 80.37 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.569 -0.825 . . . . 0.3 111.879 177.302 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.85 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.46 -37.55 90.12 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.75 -0.738 . . . . 0.23 111.483 176.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.21 -28.54 64.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.768 0.318 . . . . 0.31 110.482 176.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.607 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -64.02 -43.17 96.42 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 108.209 -1.034 . . . . 1.12 108.209 179.286 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.661 ' HB2' HD23 ' A' ' 13' ' ' LEU . 19.5 t -53.27 -55.03 27.85 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 113.861 -1.518 . . . . 0.26 110.534 173.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.437 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 71.8 t -63.36 -41.28 92.16 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-N 116.127 -0.488 . . . . 0.35 111.624 -178.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.761 ' HB3' HG21 ' A' ' 74' ' ' ILE . 37.2 mm-40 -63.7 -21.95 66.66 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.052 0.453 . . . . 2.51 111.254 178.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.523 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 36.9 m -76.2 -40.86 51.24 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.618 -0.882 . . . . 0.28 108.618 172.692 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 111' ' ' CYS . 81.0 t -66.62 -37.37 79.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.967 0.889 . . . . 1.23 109.628 -178.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -52.41 -50.21 62.96 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 113.38 -1.736 . . . . 0.6 111.37 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.507 ' HE2' ' O ' ' A' ' 113' ' ' GLU . 11.2 mmtt -90.73 14.96 12.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.491 . . . . 1.62 110.525 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 63.55 53.12 2.14 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.81 0.814 . . . . 1.88 111.075 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.543 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 25.5 mtm -130.1 44.27 2.99 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.804 -1.089 . . . . 0.31 108.073 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.494 ' HG2' HG13 ' A' ' 115' ' ' VAL . 4.5 mt-30 -60.92 -7.57 2.51 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.786 -1.097 . . . . 1.15 113.068 -174.475 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.534 HG23 HD22 ' A' ' 122' ' ' LEU . 35.0 m -65.43 -26.04 38.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 122.225 -0.297 . . . . 0.46 111.089 175.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.74 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -72.51 -27.75 62.45 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.463 -0.335 . . . . 0.26 110.536 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.633 HG22 ' SG ' ' A' ' 111' ' ' CYS . 68.0 t -43.65 -53.03 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 O-C-N 123.968 0.793 . . . . 0.25 111.936 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.568 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 10.3 t -72.14 -40.46 68.04 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.748 0.309 . . . . 1.35 110.932 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.74 ' HD2' HD13 ' A' ' 122' ' ' LEU . 92.0 mtt180 -59.98 -53.86 52.85 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 116.158 -0.474 . . . . 2.67 110.589 -176.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.635 ' HA ' ' CZ2' ' A' ' 129' ' ' TRP . 87.2 mt -52.41 -48.4 45.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.361 -0.836 . . . . 0.23 110.99 -178.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.563 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -60.14 -27.46 67.1 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.147 0.425 . . . . 0.29 112.147 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.78 -61.41 2.08 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 121.486 0.66 . . . . 0.28 110.358 -177.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.635 ' CZ2' ' HA ' ' A' ' 126' ' ' ILE . 27.3 p-90 -80.03 -18.07 51.13 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.169 -0.923 . . . . 3.91 111.799 -176.423 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.706 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 12.4 mmm -58.12 -54.1 50.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.396 0.617 . . . . 1.08 109.446 168.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.551 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -64.63 -41.52 96.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.586 -0.734 . . . . 0.25 110.888 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.541 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 70.1 m -57.9 -50.32 73.73 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.98 0.363 . . . . 0.4 111.98 176.569 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.544 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 4.4 m-85 -59.34 -34.77 72.76 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.263 -0.175 . . . . 3.13 111.194 -178.211 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.823 HD13 ' HB3' ' A' ' 5' ' ' ASN . 4.2 tt -62.02 -55.99 23.63 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.218 -1.03 . . . . 0.95 108.218 170.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ASN . . . . . 0.59 ' OD1' ' HB3' ' A' ' 2' ' ' SER . 6.0 m-80 -47.08 -51.3 18.01 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.114 -0.948 . . . . 0.46 112.606 -178.588 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -84.76 -45.78 12.05 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.203 0.446 . . . . 0.59 112.203 -173.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' HIS . . . . . 0.544 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 18.3 m-70 -91.02 -49.92 6.14 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.734 0.642 . . . . 1.45 112.734 -171.118 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 134' ' ' LEU . 46.7 mt -91.06 -36.75 13.85 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.784 0.661 . . . . 1.2 112.784 -165.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.637 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 31.5 tt0 -49.77 -50.73 65.7 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 123.54 0.525 . . . . 0.75 112.25 -173.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.597 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 35.2 Cg_exo -57.19 -49.84 12.9 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 121.61 1.54 . . . . 0.56 111.494 176.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' TRP . . . . . 0.426 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 4.0 t-105 -57.74 -49.26 77.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.489 -0.778 . . . . 1.2 110.477 -178.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.619 HD12 ' HA ' ' A' ' 139' ' ' GLU . 47.0 mt -45.27 -53.32 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 122.953 0.501 . . . . 0.32 111.655 173.512 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.637 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.7 mm-40 -59.4 -32.35 70.08 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.91 -0.586 . . . . 0.57 111.513 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.2 mm-40 -66.42 -19.38 65.78 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.248 0.547 . . . . 0.78 110.909 178.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -109.75 2.5 20.11 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.478 -0.783 . . . . 0.93 110.725 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 126.87 -48.32 0.97 Allowed Glycine 0 N--CA 1.442 -0.961 0 CA-C-N 115.669 -0.696 . . . . 0.56 113.075 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 126.08 172.67 13.41 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.852 -0.69 . . . . 0.49 111.45 -177.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.622 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 67.1 m95 -65.02 -36.42 84.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.901 0.351 . . . . 3.57 111.611 -176.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.582 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 6.0 p-10 -59.95 -33.03 71.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.836 0.35 . . . . 1.96 110.634 177.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.547 ' O ' HD13 ' A' ' 154' ' ' LEU . 89.4 m -68.04 -39.99 82.93 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.047 -0.524 . . . . 0.67 110.935 178.313 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.573 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 85.9 t80 -61.53 -33.03 73.13 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.942 -0.762 . . . . 3.0 108.942 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.582 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 99.0 t -63.08 -55.71 21.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-N 114.569 -1.196 . . . . 1.15 110.786 174.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 9.5 mm-40 -47.76 -46.73 30.46 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.469 -0.787 . . . . 1.67 111.538 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.547 HD13 ' O ' ' A' ' 150' ' ' THR . 8.4 mp -75.68 -61.18 2.01 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.233 0.827 . . . . 1.3 113.233 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -120.79 21.18 11.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.487 -0.324 . . . . 4.24 111.822 -166.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.714 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -67.25 179.08 15.6 Favored Glycine 0 N--CA 1.45 -0.422 0 N-CA-C 115.729 1.051 . . . . 1.1 115.729 -172.169 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -73.04 109.49 6.61 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 113.208 -1.496 . . . . 1.29 110.683 -177.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 1.009 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 4.0 m-20 -81.1 -7.77 59.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.613 0.598 . . . . 2.99 112.613 -173.544 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.89 -36.21 76.48 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.303 -0.628 . . . . 2.52 109.303 171.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -100.21 -36.74 9.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.563 -0.744 . . . . 2.87 110.751 174.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 1.009 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -55.11 -51.31 66.82 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.167 -0.47 . . . . 3.2 111.862 -178.215 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.473 ' HG3' ' HB3' ' A' ' 158' ' ' ASN . 44.3 mt-10 -72.65 -27.47 62.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.783 0.325 . . . . 3.72 110.842 -176.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 53.4 m -65.53 -30.54 71.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.14 0.495 . . . . 4.18 110.266 175.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -91.48 -11.54 37.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.248 0.547 . . . . 5.82 111.259 175.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.421 ' HB3' ' HA ' ' A' ' 162' ' ' GLU . 39.6 ttmt -84.28 -25.98 28.94 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.751 -0.658 . . . . 4.77 110.988 -175.08 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -55.26 -45.13 83.95 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 121.155 -0.545 . . . . 5.1 113.359 -174.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -80.12 -23.68 41.02 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 122.417 -0.461 . . . . 5.72 111.135 -179.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -81.44 -5.4 57.87 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.677 0.751 . . . . 5.88 109.17 178.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.571 ' HD2' ' O ' ' A' ' 169' ' ' ARG . 5.0 tmm_? -89.77 -29.05 18.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.085 -0.961 . . . . 7.34 108.81 177.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 170' ' ' LEU . 4.3 mm? -84.08 -30.28 26.13 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.519 -0.764 . . . . 6.97 109.997 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 73.12 144.88 0.07 Allowed 'General case' 0 C--O 1.234 0.255 0 O-C-N 124.415 1.072 . . . . 6.97 112.065 172.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -83.17 125.25 31.33 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.179 -0.674 . . . . 9.35 109.179 174.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -111.36 162.02 15.47 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.033 0.444 . . . . 11.4 111.484 -173.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 48.2 m80 -73.4 140.91 46.9 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.498 -0.774 . . . . 11.52 110.69 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -84.96 -24.75 28.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.948 -0.569 . . . . 14.48 109.511 175.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 74.5 m80 -124.89 109.73 13.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.726 -0.67 . . . . 15.37 109.494 176.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -138.28 -31.49 0.75 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.277 -0.42 . . . . 16.02 110.914 -175.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 98.8 mt 67.5 2.47 2.94 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.023 0.529 . . . . 17.99 111.5 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 59.85 -88.86 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 123.423 0.689 . . . . 19.19 111.982 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 180' ' ' HIS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 183' ' ' HIS . 97.4 m-70 -123.03 141.15 52.27 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.731 -0.47 . . . . 22.26 109.731 -178.313 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -86.79 -41.77 13.82 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.371 -0.377 . . . . 22.51 110.809 -177.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 10.1 p80 -150.42 21.46 0.83 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.238 0.542 . . . . 24.89 110.291 178.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 183' ' ' HIS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 180' ' ' HIS . 18.3 t60 -101.96 115.56 30.8 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.799 -0.637 . . . . 25.58 109.869 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -140.93 129.9 23.2 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.098 -0.501 . . . . 27.37 109.812 178.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 86.0 t60 . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.387 -0.816 . . . . 29.06 110.252 -179.454 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.237 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . 78.21 -71.72 2.41 Favored Glycine 0 N--CA 1.45 -0.433 0 O-C-N 121.7 -0.625 . . . . 2.97 112.36 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1003 ' ' CYS . . . . . . . . . . . . . 9.8 m -119.36 -155.9 0.63 Allowed 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.8 -0.444 . . . . 1.94 109.8 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.955 HG23 ' H ' ' B' 1005 ' ' GLY . 33.1 m 46.9 -84.68 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 O-C-N 124.547 1.154 . . . . 1.63 112.92 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B 1005 ' ' GLY . . . . . 0.955 ' H ' HG23 ' B' 1004 ' ' VAL . . . -37.15 -38.36 0.35 Allowed Glycine 0 CA--C 1.533 1.195 0 CA-C-N 119.219 0.918 . . . . 1.2 112.774 161.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B 1006 ' ' ARG . . . . . 0.527 ' HA ' ' CZ ' ' B' 1006 ' ' ARG . 1.6 tpm_? -56.32 -52.3 65.07 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.707 0.765 . . . . 2.88 111.669 172.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B 1007 ' ' ALA . . . . . 0.767 ' HB2' ' H7 ' ' B' 1100 ' ' 33B . . . -99.67 -153.5 0.44 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.571 -1.195 . . . . 1.31 110.063 -172.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.998 ' HG ' HG13 ' A' ' 86' ' ' VAL . 2.8 mm? 64.43 -74.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 O-C-N 123.963 0.789 . . . . 1.33 111.384 174.373 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B 1009 ' ' ALA . . . . . 1.002 ' HB2' ' HB3' ' A' ' 89' ' ' GLU . . . -46.06 -64.3 0.78 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.632 0.73 . . . . 0.88 110.574 169.138 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' B' 1013 ' ' ASP . . . -52.5 -40.06 61.97 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 114.597 -1.183 . . . . 1.03 112.43 -178.017 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.495 ' CG ' ' C13' ' B' 1100 ' ' 33B . 80.6 m-85 -98.75 7.02 46.55 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.188 -0.46 . . . . 1.67 111.297 -172.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.79 -16.89 79.16 Favored Glycine 0 CA--C 1.501 -0.787 0 N-CA-C 108.726 -1.75 . . . . 0.78 108.726 166.282 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1013 ' ' ASP . . . . . 0.419 ' HB3' ' O ' ' B' 1010 ' ' ALA . 17.4 t70 -72.78 -2.88 22.19 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.36 -1.42 . . . . 1.9 110.863 171.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B 1014 ' ' CYS . . . . . 0.705 ' SG ' ' HB3' ' A' ' 60' ' ' ARG . 15.3 t -59.39 -37.38 77.84 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 121.334 0.588 . . . . 1.44 110.057 178.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.474 HG23 ' HA3' ' A' ' 98' ' ' GLY . 14.6 tt -115.46 47.49 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-O 122.437 1.113 . . . . 2.91 109.531 -178.269 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 50.2 t-20 -75.47 -55.4 5.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.837 -1.074 . . . . 4.29 109.774 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -147.45 -74.51 0.2 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.948 -0.569 . . . . 8.17 110.397 -177.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.586 0 CA-C-N 116.593 -0.276 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.767 ' H7 ' ' HB2' ' B' 1007 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.9 mtt . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 109.959 -0.385 . . . . 6.21 109.959 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.8 p -137.19 -48.19 0.59 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.827 0.346 . . . . 1.87 110.906 178.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.448 ' O ' ' HB2' ' A' ' 37' ' ' ALA . 20.7 mp0 -79.8 1.43 26.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.865 0.364 . . . . 2.42 111.257 -178.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -20.67 66.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.3 -0.409 . . . . 1.25 111.461 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.947 ' HA ' HD22 ' A' ' 8' ' ' LEU . 13.5 m120 -64.65 -22.35 66.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.21 -0.45 . . . . 1.78 110.477 178.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.835 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.2 tpp180 -54.81 -52.95 61.09 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.814 -0.63 . . . . 1.4 110.449 176.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.824 ' HB3' ' HE3' ' A' ' 47' ' ' LYS . 46.9 mt-10 -57.94 -46.39 85.13 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.274 -0.876 . . . . 0.68 110.905 -177.498 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.947 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.2 OUTLIER -52.77 -32.49 43.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.078 -0.965 . . . . 1.16 111.217 179.304 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.5 HG21 ' CA ' ' A' ' 131' ' ' ALA . 67.7 t -80.24 -61.1 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.308 0.575 . . . . 0.27 109.8 174.234 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.527 HG13 ' CE2' ' A' ' 24' ' ' TRP . 95.2 t -50.1 -54.77 7.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.815 -1.084 . . . . 0.33 112.506 -175.376 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -49.24 -43.28 42.59 Favored 'General case' 0 CA--C 1.52 -0.205 0 O-C-N 123.472 0.482 . . . . 0.59 110.57 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.617 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 1.6 t80 -72.43 -42.44 65.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.879 -0.6 . . . . 1.61 111.077 -175.621 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.993 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.2 mp -62.75 -40.39 97.11 Favored 'General case' 0 C--O 1.231 0.124 0 C-N-CA 120.277 -0.569 . . . . 0.34 110.185 177.027 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.7 m -62.57 -39.11 92.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.553 0.692 . . . . 1.05 109.929 176.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -63.81 -18.7 64.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.739 -1.118 . . . . 1.22 111.024 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.681 ' HE2' ' HA ' ' A' ' 16' ' ' LYS . 10.7 mmpt? -90.57 -52.77 4.73 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.31 0.576 . . . . 1.41 110.054 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.61 HD23 HG22 ' A' ' 112' ' ' VAL . 13.6 mt -55.36 -31.41 61.73 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.687 -1.142 . . . . 1.35 111.419 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.8 t -60.41 -31.1 70.07 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.962 -0.563 . . . . 0.94 111.621 177.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -75.68 -21.42 57.64 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-O 121.792 0.806 . . . . 1.37 110.448 -178.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.537 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 9.8 mmmt -96.45 -26.58 15.26 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.224 -1.353 . . . . 2.2 108.665 -174.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.03 19.4 17.08 Favored Glycine 0 N--CA 1.437 -1.295 0 CA-C-N 113.744 -1.571 . . . . 0.53 111.976 176.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.537 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 31.8 m-85 -99.63 154.9 17.91 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.753 0.311 . . . . 0.76 110.343 177.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.0 t -92.29 142.81 27.05 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.998 -0.546 . . . . 0.52 109.572 175.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.527 ' CE2' HG13 ' A' ' 10' ' ' VAL . 27.9 t-105 -74.5 -49.44 22.13 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.622 -0.51 . . . . 3.36 109.622 176.079 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.8 m -58.94 -35.89 73.86 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.771 -0.65 . . . . 1.37 111.725 -176.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -61.64 -25.78 67.58 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.894 0.378 . . . . 1.11 111.965 -178.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -120.24 19.15 12.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.358 -0.383 . . . . 1.28 110.933 -178.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.459 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 37.4 p -100.26 -178.85 3.95 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.625 0.726 . . . . 1.81 112.097 -172.153 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.519 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 5.4 t70 -161.52 -23.9 0.05 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.403 -1.271 . . . . 2.31 108.899 -178.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.866 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.4 m -53.91 -72.43 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 114.269 -1.332 . . . . 0.92 112.827 -175.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.866 ' H ' HG23 ' A' ' 30' ' ' VAL . 32.4 mt-10 -89.69 -4.26 57.82 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.632 -0.877 . . . . 2.74 108.632 178.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.519 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 23.2 tt0 -72.26 -52.32 16.87 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 114.45 -1.25 . . . . 1.45 111.222 -175.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -97.29 -34.24 11.15 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.978 0.362 . . . . 1.87 111.978 -174.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -123.61 159.1 29.98 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.768 -0.373 . . . . 3.39 110.393 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 16.7 p -120.69 103.67 9.3 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.467 0.651 . . . . 2.25 110.572 176.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.945 ' HG3' ' H ' ' A' ' 37' ' ' ALA . 10.3 pt-20 -101.06 -88.37 0.37 Allowed 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.363 -0.835 . . . . 3.34 111.329 -179.05 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.945 ' H ' ' HG3' ' A' ' 36' ' ' GLU . . . -70.16 148.24 95.82 Favored Pre-proline 0 C--N 1.309 -1.169 0 CA-C-N 115.241 -0.891 . . . . 1.92 111.503 178.456 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.78 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 76.3 Cg_exo -55.53 -173.27 0.03 OUTLIER 'Trans proline' 0 CA--C 1.535 0.542 0 C-N-CA 123.519 2.812 . . . . 1.87 112.487 169.647 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -87.83 15.24 7.31 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.338 0.59 . . . . 4.64 110.322 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 141.29 62.42 0.03 OUTLIER Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 115.594 -0.73 . . . . 2.15 111.739 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.805 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.2 t -68.8 -75.02 0.11 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 120.854 -0.338 . . . . 1.12 110.547 -177.193 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.805 ' H ' HG23 ' A' ' 41' ' ' THR . 14.2 pt-20 -92.88 -30.95 15.15 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 122.27 1.033 . . . . 2.02 108.315 168.529 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.456 ' HA ' HG13 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -56.57 -35.57 68.33 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 112.742 -2.027 . . . . 1.25 113.425 -170.932 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -45.17 -53.48 8.09 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 123.967 0.792 . . . . 1.91 111.721 -173.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.453 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -72.39 -38.96 68.34 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.794 0.294 . . . . 0.52 111.794 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.68 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 1.4 m -71.47 -41.71 72.92 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 120.939 -0.305 . . . . 1.41 111.016 -175.046 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.824 ' HE3' ' HB3' ' A' ' 7' ' ' GLU . 0.4 OUTLIER -71.77 -30.24 65.35 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.298 -0.63 . . . . 0.67 109.298 178.742 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.525 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 13.6 mm-40 -64.61 -35.68 81.79 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.99 110.266 172.307 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.643 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -75.65 -34.23 60.5 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.114 -0.493 . . . . 0.42 110.597 176.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.68 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 12.5 mt -64.02 -28.0 69.5 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 115.514 -0.767 . . . . 1.33 112.364 -176.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.501 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 7.9 ptm180 -81.07 -30.72 34.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.861 0.839 . . . . 2.17 108.998 -176.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -74.99 -49.93 18.28 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.172 -1.376 . . . . 1.1 109.786 -178.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.415 ' CB ' ' HZ ' ' A' ' 151' ' ' PHE . . . -65.45 -34.12 77.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.724 -0.671 . . . . 0.53 109.87 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.761 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -58.7 -57.33 20.42 Favored Glycine 0 N--CA 1.442 -0.911 0 CA-C-N 115.262 -0.881 . . . . 0.7 111.758 177.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -55.12 -43.16 73.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.807 0.337 . . . . 1.04 111.265 -177.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.441 ' CD ' HH21 ' B' 1017 ' ' ARG . 27.3 mm-40 -59.5 -34.25 72.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.771 -0.65 . . . . 2.29 111.479 177.664 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.621 ' CE1' ' HA2' ' B' 1012 ' ' GLY . 67.0 t80 -81.6 -40.48 22.93 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.912 -0.585 . . . . 2.29 111.323 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.761 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 56.9 mt-10 -62.92 -42.19 99.72 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.314 -0.403 . . . . 1.3 111.745 -173.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.1 pp -59.73 -19.09 47.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.22 -0.446 . . . . 1.54 111.526 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 32.8 mtp-105 -79.7 -53.67 6.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.087 -0.506 . . . . 2.58 110.953 -179.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.647 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 15.3 p90 -92.18 -5.72 52.04 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.672 0.619 . . . . 5.32 112.672 -172.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.807 ' HG3' ' HE1' ' A' ' 65' ' ' PHE . 50.8 ttt180 -50.99 -38.49 51.45 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.28 0.474 . . . . 4.48 112.28 -170.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -52.85 -38.14 61.11 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.051 0.389 . . . . 4.72 112.051 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.427 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -82.78 -48.82 10.39 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 112.906 0.706 . . . . 1.17 112.906 -172.091 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.807 ' HE1' ' HG3' ' A' ' 62' ' ' ARG . 5.1 p90 -60.04 -26.99 66.55 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.49 0.552 . . . . 2.81 112.49 -166.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.1 t -68.02 -32.71 73.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.154 0.502 . . . . 2.19 110.106 177.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -90.13 -25.82 20.5 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.583 0.706 . . . . 2.72 110.397 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.69 ' O ' HD12 ' A' ' 72' ' ' LEU . 2.0 mp -75.31 -18.02 60.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.292 -0.867 . . . . 1.56 112.424 -176.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.709 HG22 HG13 ' A' ' 74' ' ' ILE . 1.2 p -57.3 -34.42 68.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 118.147 0.431 . . . . 0.7 111.043 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 45.6 t -63.88 -41.7 97.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.385 0.612 . . . . 1.34 109.924 173.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.657 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 35.1 mt-30 -66.77 -39.12 87.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.113 -0.949 . . . . 1.42 110.652 -178.196 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.69 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mt -76.2 -30.15 57.89 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.552 -0.749 . . . . 1.37 110.408 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 68.55 50.72 0.67 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.447 0.642 . . . . 2.72 109.616 -176.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.709 HG13 HG22 ' A' ' 69' ' ' THR . 25.5 mm -55.47 114.93 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.609 -1.178 . . . . 0.91 111.419 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.765 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.95 -170.24 0.24 Allowed Pre-proline 0 CA--C 1.549 0.923 0 N-CA-C 107.514 -1.291 . . . . 0.51 107.514 -171.566 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.765 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 32.2 Cg_exo -29.33 167.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.128 0 C-N-CA 125.218 3.945 . . . . 0.47 115.326 162.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -28.56 -27.46 0.0 OUTLIER Glycine 0 N--CA 1.475 1.239 0 N-CA-C 117.828 1.891 . . . . 0.4 117.828 -173.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.469 ' N ' ' O ' ' A' ' 76' ' ' PRO . 40.7 p -65.67 1.93 1.13 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 118.946 1.373 . . . . 0.56 112.0 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.26 -12.16 60.76 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.551 -0.295 . . . . 0.34 110.262 174.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.463 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 2.8 m-85 -73.62 -22.85 59.88 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.644 -0.872 . . . . 4.13 108.644 174.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.408 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 33.5 mt-30 -81.95 -26.15 34.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.392 -0.822 . . . . 1.03 109.725 176.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.647 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 3.2 m -73.54 -51.51 16.72 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.63 -1.168 . . . . 0.48 109.05 172.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.46 ' HB2' ' HG ' ' A' ' 110' ' ' LEU . 69.3 t80 -67.66 -17.89 64.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.115 -0.948 . . . . 1.18 110.276 176.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.552 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.5 tt0 -61.64 -50.56 72.05 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.925 -0.579 . . . . 0.8 110.409 177.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -47.23 -33.33 5.31 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 114.856 -1.066 . . . . 1.62 110.311 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.872 HG13 HD12 ' B' 1008 ' ' LEU . 1.3 t -85.91 -55.13 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.981 0 CA-C-N 114.01 -1.45 . . . . 1.3 110.912 -174.809 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.552 HG12 ' HA ' ' A' ' 84' ' ' GLU . 4.9 p -62.86 -17.95 20.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-O 122.098 0.951 . . . . 0.85 109.959 -176.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.547 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 4.5 m-80 -86.02 -35.58 20.26 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.148 -1.387 . . . . 0.91 112.057 176.073 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 1.022 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.2 pp20? -74.65 -35.58 62.85 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 122.107 0.956 . . . . 2.87 108.518 177.348 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.625 HD12 ' HD2' ' A' ' 99' ' ' ARG . 0.1 OUTLIER -67.13 -33.36 75.28 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 113.569 -1.651 . . . . 1.28 110.879 -167.921 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.671 ' HA ' HG22 ' A' ' 95' ' ' VAL . 2.9 p90 -98.53 -16.62 19.09 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.774 -0.37 . . . . 2.3 111.097 -174.006 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.615 ' CD ' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -88.81 -30.15 19.19 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.35 -0.54 . . . . 5.06 111.139 -177.179 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -92.24 2.63 56.5 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.662 0.616 . . . . 3.12 112.662 -168.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 131.67 71.78 0.1 OUTLIER Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 117.339 -2.362 . . . . 2.31 114.954 -174.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.671 HG22 ' HA ' ' A' ' 91' ' ' PHE . 49.1 t -70.14 98.52 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 118.144 0.972 . . . . 1.06 110.492 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.452 ' H ' ' CB ' ' A' ' 99' ' ' ARG . 3.0 m-20 -108.93 -179.06 3.75 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.311 -1.313 . . . . 2.12 108.902 178.1 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.809 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 19.3 m-90 -51.37 -52.9 41.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.224 0.535 . . . . 3.34 111.015 176.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.791 ' HA3' HG21 ' B' 1015 ' ' ILE . . . -81.36 -14.18 79.12 Favored Glycine 0 CA--C 1.519 0.324 0 CA-C-N 115.759 -0.655 . . . . 0.69 113.637 -175.295 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.625 ' HD2' HD12 ' A' ' 90' ' ' LEU . 9.4 tpp180 -63.21 -42.4 99.28 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.291 0.567 . . . . 4.24 110.496 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.569 HG22 ' CE2' ' A' ' 104' ' ' PHE . 89.8 mt -72.89 -33.61 44.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.671 . . . . 0.44 110.438 -179.438 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.521 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 72.8 t -49.1 -54.45 5.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.764 -0.653 . . . . 1.35 109.804 168.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.423 ' HB1' ' CE2' ' A' ' 106' ' ' PHE . . . -52.49 -47.22 66.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.886 -1.052 . . . . 0.44 111.126 175.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.404 ' CE1' HG23 ' A' ' 87' ' ' VAL . 9.7 t80 -55.56 -39.67 70.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.579 -0.737 . . . . 1.49 111.395 178.408 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.569 ' CE2' HG22 ' A' ' 100' ' ' ILE . 30.7 m-85 -69.92 -33.74 72.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.632 0.253 . . . . 3.29 110.88 175.234 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.617 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 18.1 t -68.58 -53.84 20.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.484 -0.325 . . . . 1.19 110.674 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.553 ' CZ ' ' HB3' ' B' 1008 ' ' LEU . 35.4 m-85 -63.98 -38.63 91.78 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-O 120.552 0.215 . . . . 2.89 110.581 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -69.82 -39.18 76.32 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.619 -0.801 . . . . 0.3 111.792 177.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.993 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.04 -36.19 91.63 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 111.303 -0.719 . . . . 0.23 111.303 176.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -73.59 -29.14 62.21 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.229 -0.285 . . . . 0.31 110.229 175.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.46 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -61.3 -40.68 95.07 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 107.723 -1.214 . . . . 1.12 107.723 178.155 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.717 ' SG ' HG22 ' A' ' 123' ' ' VAL . 39.9 t -51.57 -63.73 1.04 Allowed 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 113.612 -1.631 . . . . 0.26 110.174 172.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.896 ' HA ' HG13 ' A' ' 115' ' ' VAL . 43.6 t -64.15 -37.89 81.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.202 0.445 . . . . 0.35 112.202 -174.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.614 ' HB3' HG21 ' A' ' 74' ' ' ILE . 13.6 mm-40 -59.52 -16.95 27.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.185 0.517 . . . . 2.51 110.767 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.578 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 63.9 m -85.1 -46.86 10.74 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 107.997 -1.112 . . . . 0.28 107.997 176.34 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.896 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.7 m -66.38 -34.22 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-N 114.783 -1.099 . . . . 1.23 109.897 -174.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -50.32 -51.31 46.45 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 113.066 -1.879 . . . . 0.6 111.153 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' ' 113' ' ' GLU . 24.1 mmtt -86.0 15.5 4.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.796 -0.638 . . . . 1.62 110.109 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 65.89 49.29 1.67 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 122.037 0.922 . . . . 1.88 110.176 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.578 ' CE ' ' HA ' ' A' ' 114' ' ' SER . 27.9 mtm -129.59 37.12 4.02 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.329 -1.305 . . . . 0.31 107.889 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.771 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 0.0 OUTLIER -54.51 -8.05 0.2 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.921 -1.036 . . . . 1.15 112.684 -179.834 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.578 HG23 HD22 ' A' ' 122' ' ' LEU . 27.3 m -68.25 -22.5 27.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 O-C-N 122.102 -0.374 . . . . 0.46 111.868 176.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.615 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.6 mm? -75.26 -24.89 57.66 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 120.956 0.408 . . . . 0.26 110.137 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.717 HG22 ' SG ' ' A' ' 111' ' ' CYS . 46.7 t -45.19 -52.55 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 114.857 -1.065 . . . . 0.25 112.346 -176.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.459 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 0.1 OUTLIER -75.46 -33.59 60.86 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 121.044 0.449 . . . . 1.35 111.196 -178.468 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.615 ' HD2' HD13 ' A' ' 122' ' ' LEU . 74.0 mtt180 -65.97 -52.5 49.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.67 -0.695 . . . . 2.67 110.738 -176.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.553 HG22 ' SD ' ' A' ' 130' ' ' MET . 69.5 mt -53.6 -49.97 52.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.769 -0.651 . . . . 0.23 111.331 179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.641 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.17 -32.53 68.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.624 -0.262 . . . . 0.29 111.58 -177.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.835 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -58.75 -61.68 2.44 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.198 0.523 . . . . 0.28 110.353 176.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -62.11 -35.67 79.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.86 -1.064 . . . . 3.91 111.2 -176.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.553 ' SD ' HG22 ' A' ' 126' ' ' ILE . 88.2 mtp -60.86 -54.59 43.18 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.779 0.323 . . . . 1.08 111.435 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.5 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -62.23 -43.01 99.79 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.26 -0.427 . . . . 0.25 111.004 -178.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 97.2 m -61.4 -44.39 97.23 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.838 -0.345 . . . . 0.4 110.695 177.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.458 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 26.6 t80 -56.7 -40.24 75.27 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.153 -0.314 . . . . 3.13 110.153 178.493 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.925 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 3.8 tt -61.42 -54.88 37.8 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.78 -0.822 . . . . 0.95 108.78 174.099 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -51.75 -44.02 63.16 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.181 -0.918 . . . . 0.46 112.426 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -84.68 -52.69 5.9 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.215 0.531 . . . . 0.59 111.906 -175.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' HIS . . . . . 0.458 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 7.2 m80 -91.4 -51.77 5.12 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 113.124 0.787 . . . . 1.45 113.124 -171.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.925 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -80.74 -45.6 16.8 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.007 1.114 . . . . 1.2 114.007 -165.081 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.712 ' HA ' HD12 ' A' ' 142' ' ' ILE . 27.6 tt0 -44.99 -50.29 26.74 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 112.689 0.626 . . . . 0.75 112.689 -174.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.571 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 51.3 Cg_exo -54.38 -50.87 12.0 Favored 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 121.856 1.704 . . . . 0.56 111.861 176.127 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 -58.02 -49.5 76.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.529 -0.759 . . . . 1.2 110.31 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.712 HD12 ' HA ' ' A' ' 139' ' ' GLU . 61.8 mt -46.58 -53.91 2.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.921 -0.581 . . . . 0.32 111.683 175.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.563 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 72.3 mm-40 -60.14 -30.72 69.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.846 -0.616 . . . . 0.57 111.739 -178.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 6.4 mm-40 -68.28 -22.9 64.71 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.354 0.597 . . . . 0.78 110.746 177.161 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -99.54 -20.9 16.15 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.421 -0.808 . . . . 0.93 110.151 -173.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 146.7 -33.57 1.4 Allowed Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.791 -0.719 . . . . 0.56 112.686 175.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' GLY . . . . . 0.551 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 110.1 169.92 19.89 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.565 -0.826 . . . . 0.49 111.844 -177.442 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.533 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 65.2 m95 -68.03 -34.39 76.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.731 0.265 . . . . 3.57 111.568 -178.416 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -58.25 -47.1 84.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.067 0.46 . . . . 1.96 110.243 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.542 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 95.4 m -61.0 -35.37 76.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.606 -0.724 . . . . 0.67 111.178 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.809 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 84.0 t80 -59.54 -40.96 88.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.742 0.306 . . . . 3.0 110.672 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.559 HG12 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -73.8 -24.94 20.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.322 0.582 . . . . 1.15 110.089 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.78 -22.45 66.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.066 0.46 . . . . 1.67 109.948 173.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 150' ' ' THR . 5.0 mt -94.33 -58.34 2.24 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.916 -0.584 . . . . 1.3 110.779 177.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -121.25 27.74 8.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.976 -0.556 . . . . 4.24 111.591 -173.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.643 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -65.7 163.43 40.24 Favored Glycine 0 CA--C 1.497 -1.083 0 C-N-CA 120.865 -0.683 . . . . 1.1 113.056 -178.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.525 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 24.9 t-20 -63.64 108.68 1.46 Allowed 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 114.205 -0.998 . . . . 1.29 110.68 178.703 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.744 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 6.0 m120 -82.0 -24.04 35.65 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.322 -0.399 . . . . 2.99 111.414 -177.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -53.97 -45.13 71.26 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-O 120.773 0.321 . . . . 2.52 111.109 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -82.37 -35.55 27.67 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.237 -0.438 . . . . 2.87 110.556 177.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.556 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -55.12 -60.83 2.84 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.844 -0.616 . . . . 3.2 111.284 -179.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.744 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 10.4 pt-20 -65.92 -29.15 69.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.65 -0.25 . . . . 3.72 111.531 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 37.6 t -64.77 -40.31 95.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.129 0.49 . . . . 4.18 110.139 -178.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -90.5 -0.47 57.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.978 -0.555 . . . . 5.82 110.379 178.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.561 ' HB3' ' HA ' ' A' ' 162' ' ' GLU . 34.0 ttpt -100.3 -56.15 2.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.549 -0.75 . . . . 4.77 111.267 -177.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -65.7 -11.92 55.15 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.585 -0.734 . . . . 5.1 113.491 -172.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -68.93 -21.43 64.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.951 0.376 . . . . 5.72 110.368 176.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -76.0 -5.91 48.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.982 -0.554 . . . . 5.88 110.571 176.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.593 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 1.1 tmt_? -85.74 -28.8 24.36 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.288 -0.634 . . . . 7.34 109.288 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 170' ' ' LEU . 3.7 mm? -99.87 -63.51 1.12 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.907 -0.588 . . . . 6.97 110.121 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -113.66 -158.7 0.67 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.08 -0.711 . . . . 6.97 109.08 176.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 54.5 m80 -139.7 116.06 10.57 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.05 0.452 . . . . 9.35 110.833 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 30.9 t60 -83.94 -36.24 23.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.735 -0.666 . . . . 11.4 109.641 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -76.92 -48.44 18.21 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.737 -0.665 . . . . 11.52 110.242 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 60.3 t60 -84.7 105.97 15.9 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.008 -0.542 . . . . 14.48 110.465 177.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 35.8 m-70 -84.17 110.99 18.94 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.384 -0.371 . . . . 15.37 110.197 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -67.69 -38.27 83.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.914 -0.585 . . . . 16.02 111.072 -178.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 39.2 tp 65.19 106.83 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.13 0 O-C-N 123.919 0.762 . . . . 17.99 110.409 -176.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 46.9 mm-40 -75.05 170.22 16.45 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.284 -0.416 . . . . 19.19 111.007 -177.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -69.32 121.4 16.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.932 -0.576 . . . . 22.26 110.851 -177.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -72.39 125.64 27.88 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.989 -0.551 . . . . 22.51 110.91 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -81.58 153.57 26.66 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.891 -0.595 . . . . 24.89 110.273 177.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 66.65 32.07 7.29 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 123.51 0.506 . . . . 25.58 110.909 -178.125 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -121.27 75.7 1.18 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.262 -0.426 . . . . 27.37 110.549 178.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 52.1 m80 . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.205 -0.902 . . . . 29.06 109.906 175.732 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.158 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -73.47 -40.91 46.47 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.926 -0.654 . . . . 2.97 112.592 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.468 ' HA ' ' C2 ' ' B' 1100 ' ' 33B . 5.1 m -122.9 -150.46 0.45 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 122.458 -0.437 . . . . 1.94 110.512 -176.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.911 ' HA ' ' HG ' ' B' 1008 ' ' LEU . 10.8 m 42.27 -92.42 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 O-C-N 124.515 1.135 . . . . 1.63 112.992 175.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 1005 ' ' GLY . . . . . 0.677 ' H ' HG23 ' B' 1004 ' ' VAL . . . -31.56 -42.57 0.1 OUTLIER Glycine 0 CA--C 1.529 0.937 0 CA-C-N 118.351 0.523 . . . . 1.2 113.708 164.566 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -94.07 -40.48 10.05 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 111.922 0.341 . . . . 2.88 111.922 176.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1007 ' ' ALA . . . . . 0.578 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -78.52 -48.16 15.87 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 113.119 0.785 . . . . 1.31 113.119 -167.333 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.911 ' HG ' ' HA ' ' B' 1004 ' ' VAL . 7.7 mt -75.22 -37.31 61.17 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.279 -0.637 . . . . 1.33 109.279 -171.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 1009 ' ' ALA . . . . . 1.022 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -52.86 -49.79 65.09 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.002 -0.999 . . . . 0.88 110.169 169.161 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.781 ' HB1' ' N11' ' B' 1100 ' ' 33B . . . -68.28 -50.18 55.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.283 -1.326 . . . . 1.03 111.966 -176.106 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.613 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 34.1 m-85 -73.14 -23.17 60.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.138 -0.483 . . . . 1.67 111.478 -177.412 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 1012 ' ' GLY . . . . . 0.621 ' HA2' ' CE1' ' A' ' 57' ' ' PHE . . . -74.61 -10.1 82.66 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 121.018 -0.611 . . . . 0.78 113.01 -177.234 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -74.51 -20.96 59.78 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.08 0.467 . . . . 1.9 110.898 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -98.03 93.16 6.14 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.447 -0.342 . . . . 1.44 110.886 -175.097 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.791 HG21 ' HA3' ' A' ' 98' ' ' GLY . 19.1 pt -115.19 37.79 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.576 0.703 . . . . 2.91 110.61 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 20.8 p30 -155.3 29.87 0.39 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.294 -0.866 . . . . 4.29 109.997 -176.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 1017 ' ' ARG . . . . . 0.441 HH21 ' CD ' ' A' ' 56' ' ' GLU . 17.8 mmt180 61.38 79.88 0.24 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.368 -0.833 . . . . 8.17 110.645 -174.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 116.306 -0.407 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.781 ' N11' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.6 ptt? . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 121.665 0.745 . . . . 6.21 110.323 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.0 m -87.11 125.25 34.02 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.48 -0.782 . . . . 1.87 110.887 -177.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.479 ' O ' ' HB2' ' A' ' 37' ' ' ALA . 72.1 mm-40 -64.03 -25.4 68.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.08 0.467 . . . . 2.42 110.13 176.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.11 -17.69 64.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.458 -0.792 . . . . 1.25 112.467 -177.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.894 ' HB3' HD13 ' A' ' 134' ' ' LEU . 21.8 m-20 -67.86 -15.76 63.77 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 120.52 -0.472 . . . . 1.78 110.005 178.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.561 HH12 ' HA ' ' A' ' 128' ' ' ALA . 12.3 tpp180 -56.83 -48.91 76.95 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.921 -0.581 . . . . 1.4 109.747 174.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.512 ' OE1' ' HA2' ' A' ' 40' ' ' GLY . 33.9 mt-10 -53.49 -51.81 61.58 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.768 -1.105 . . . . 0.68 111.118 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.623 HD22 ' HA ' ' A' ' 5' ' ' ASN . 1.2 mp -49.13 -35.04 15.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.864 -1.062 . . . . 1.16 111.499 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.523 HG21 ' N ' ' A' ' 131' ' ' ALA . 72.4 t -80.63 -59.54 2.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.837 -0.62 . . . . 0.27 110.375 175.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 6' ' ' ARG . 85.0 t -51.96 -55.64 8.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.852 -1.067 . . . . 0.33 113.059 -176.127 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -54.97 -30.85 60.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.974 0.416 . . . . 0.59 110.493 -176.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.74 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 4.0 t80 -79.18 -51.51 9.41 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.889 -0.596 . . . . 1.61 110.546 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.952 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.0 mp -58.89 -42.95 90.77 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 121.01 -0.276 . . . . 0.34 110.899 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.43 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 38.4 t -58.39 -40.43 82.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.283 0.563 . . . . 1.05 110.424 178.239 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -71.56 -23.75 61.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.795 -0.639 . . . . 1.22 110.289 -179.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.631 ' HE2' ' HA ' ' A' ' 16' ' ' LYS . 10.2 mmpt? -85.1 -28.78 25.36 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 116.457 -0.338 . . . . 1.41 110.929 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.481 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -72.73 -26.33 61.54 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.066 -0.654 . . . . 1.35 109.396 172.783 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.7 t -65.18 -33.78 76.82 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.58 -0.736 . . . . 0.94 111.735 -178.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 16.8 pt20 -76.11 -6.04 49.35 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.367 0.603 . . . . 1.37 111.022 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.526 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.5 mmmt -109.01 -27.78 9.46 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.961 0.886 . . . . 2.2 108.854 -178.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.4 23.25 9.69 Favored Glycine 0 N--CA 1.441 -1.009 0 CA-C-N 113.996 -1.457 . . . . 0.53 111.438 177.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.508 ' HD2' ' HZ ' ' A' ' 27' ' ' PHE . 84.4 m-85 -110.55 163.58 13.57 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.033 0.444 . . . . 0.76 111.003 179.504 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.8 t -101.42 145.37 29.04 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.821 -0.627 . . . . 0.52 110.176 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.43 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.5 OUTLIER -69.78 -47.46 62.82 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.044 -0.526 . . . . 3.36 110.713 176.573 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.7 t -75.6 -23.18 56.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.417 -0.356 . . . . 1.37 111.599 -170.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -61.39 -25.47 67.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.222 0.534 . . . . 1.11 111.124 176.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.508 ' HZ ' ' HD2' ' A' ' 22' ' ' TYR . 6.6 m-85 -113.09 -22.21 10.66 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.979 -0.555 . . . . 1.28 111.16 -176.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.581 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 19.3 m -101.24 144.87 29.58 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 122.32 1.057 . . . . 1.81 112.163 -178.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -118.18 -5.21 10.92 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.379 -1.737 . . . . 2.31 109.512 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.793 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.4 m -53.57 -73.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.135 -1.393 . . . . 0.92 113.257 -165.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.793 ' H ' HG23 ' A' ' 30' ' ' VAL . 10.4 pt-20 -96.97 2.12 51.15 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.122 -0.696 . . . . 2.74 109.122 177.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -71.29 -57.68 4.24 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.761 -1.108 . . . . 1.45 110.803 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 -89.54 -55.11 3.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.779 -0.646 . . . . 1.87 110.833 -174.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -91.42 157.04 17.3 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.148 -0.686 . . . . 3.39 109.148 174.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 16.6 p -103.6 108.0 19.08 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.426 0.631 . . . . 2.25 110.834 -178.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -103.77 -84.25 0.48 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.306 -0.861 . . . . 3.34 110.584 -176.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 3' ' ' GLN . . . -101.5 151.65 37.86 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.007 -0.542 . . . . 1.92 111.182 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.763 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 32.5 Cg_exo -61.44 169.6 6.43 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.904 2.403 . . . . 1.87 110.912 168.509 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -81.23 -1.8 46.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.347 0.594 . . . . 4.64 110.825 -178.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.512 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 170.36 68.42 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.639 -0.71 . . . . 2.15 111.798 176.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.894 HG23 ' H ' ' A' ' 42' ' ' GLU . 3.5 t -80.5 -75.36 0.27 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 120.351 -0.54 . . . . 1.12 110.543 -177.404 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.894 ' H ' HG23 ' A' ' 41' ' ' THR . 13.4 pt-20 -94.45 -32.19 13.64 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 122.384 1.088 . . . . 2.02 109.789 171.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.685 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 51.7 m -62.71 -24.53 67.71 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 113.206 -1.815 . . . . 1.25 114.816 -165.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -39.42 -55.52 1.75 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.517 0.511 . . . . 1.91 112.251 -172.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.475 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -70.52 -40.07 73.72 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.796 0.295 . . . . 0.52 111.796 179.222 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.631 ' HB ' ' HB3' ' A' ' 148' ' ' TRP . 2.0 m -67.74 -44.2 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 121.239 -0.185 . . . . 1.41 111.189 -176.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.685 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.8 ptpt -69.93 -39.42 76.12 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.536 -0.542 . . . . 0.67 109.536 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.497 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 33.2 mm-40 -59.1 -33.62 71.05 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.714 -0.676 . . . . 0.99 111.17 174.435 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.54 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -76.83 -39.41 51.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.39 0.614 . . . . 0.42 110.716 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.422 HD12 ' CE2' ' A' ' 151' ' ' PHE . 1.0 OUTLIER -65.79 -25.97 67.48 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.286 -0.87 . . . . 1.33 112.548 -174.63 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.512 ' HG3' ' HG2' ' A' ' 52' ' ' GLU . 8.2 ptp180 -83.34 -27.46 29.7 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.8 0.81 . . . . 2.17 109.335 -175.015 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.512 ' HG2' ' HG3' ' A' ' 51' ' ' ARG . 4.3 mm-40 -80.17 -39.96 28.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.201 -1.363 . . . . 1.1 109.715 -179.273 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.52 -41.57 75.85 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.581 -0.736 . . . . 0.53 109.836 172.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.662 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.13 -31.96 74.65 Favored Glycine 0 C--O 1.222 -0.617 0 CA-C-N 115.533 -0.758 . . . . 0.7 111.577 177.052 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -54.26 -39.16 66.6 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 122.591 0.356 . . . . 1.04 111.032 177.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.462 ' HA ' HD21 ' A' ' 59' ' ' LEU . 2.9 tt0 -79.66 -26.48 41.03 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.667 0.746 . . . . 2.29 110.574 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.412 ' CE1' ' HB2' ' A' ' 102' ' ' ALA . 10.4 m-85 -80.99 -18.41 47.0 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.084 -0.507 . . . . 2.29 112.269 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.662 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 40.1 mt-10 -66.95 -68.49 0.37 Allowed 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 120.603 0.24 . . . . 1.3 110.941 -177.23 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.611 HD23 ' H ' ' A' ' 59' ' ' LEU . 1.9 pt? -48.01 -38.78 17.89 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.529 -0.76 . . . . 1.54 111.242 178.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.514 ' N ' ' HG ' ' A' ' 59' ' ' LEU . 66.0 mtt180 -54.67 -53.79 50.16 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.041 -0.527 . . . . 2.58 111.034 -177.457 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -85.25 -21.3 29.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.987 -0.551 . . . . 5.32 110.678 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.783 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 43.5 ttm180 -56.16 -28.5 58.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.12 -0.491 . . . . 4.48 110.889 179.35 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 63' ' ' ARG . 12.5 mmt180 -57.52 -55.6 32.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.77 -0.65 . . . . 4.72 111.297 176.572 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.459 ' HB1' HD13 ' A' ' 68' ' ' LEU . . . -91.84 -32.78 15.2 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.996 0.739 . . . . 1.17 112.996 -173.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.854 ' HA ' ' HB2' ' A' ' 68' ' ' LEU . 0.3 OUTLIER -61.07 -25.44 66.94 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.813 0.671 . . . . 2.81 112.813 -166.566 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.4 m -63.66 -36.07 82.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.292 0.567 . . . . 2.19 110.443 177.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -90.45 -32.41 16.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.493 -0.776 . . . . 2.72 109.926 176.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.854 ' HB2' ' HA ' ' A' ' 65' ' ' PHE . 4.0 mp -64.67 -24.83 67.7 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 115.589 -0.732 . . . . 1.56 112.465 -178.492 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.791 HG22 HG13 ' A' ' 74' ' ' ILE . 2.5 p -61.38 -26.07 67.59 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.498 -0.481 . . . . 0.7 110.731 177.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 29.4 t -72.22 -39.35 68.59 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 109.248 -0.649 . . . . 1.34 109.248 172.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.806 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 33.4 mt-30 -63.62 -52.53 60.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.535 -0.757 . . . . 1.42 110.299 178.534 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.707 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mp -67.5 -31.33 71.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.465 -0.789 . . . . 1.37 110.5 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 64.18 66.22 0.64 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 121.567 0.699 . . . . 2.72 109.464 -173.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.791 HG13 HG22 ' A' ' 69' ' ' THR . 25.3 mm -62.04 117.61 3.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.648 -1.16 . . . . 0.91 110.426 178.341 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.745 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -159.57 -172.52 0.33 Allowed Pre-proline 0 C--N 1.316 -0.881 0 N-CA-C 107.723 -1.214 . . . . 0.51 107.723 -169.481 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.745 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 38.2 Cg_exo -29.79 166.32 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.959 3.773 . . . . 0.47 114.996 164.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.449 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.03 -29.3 0.01 OUTLIER Glycine 0 N--CA 1.475 1.279 0 N-CA-C 117.211 1.644 . . . . 0.4 117.211 -175.033 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.448 ' N ' ' O ' ' A' ' 76' ' ' PRO . 23.9 p -67.71 1.23 2.6 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.949 0.874 . . . . 0.56 112.358 178.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.401 ' HB2' ' H ' ' A' ' 75' ' ' THR . . . -72.3 -13.93 61.62 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.101 0.476 . . . . 0.34 110.125 171.343 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.441 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 53.5 t80 -75.28 -22.41 57.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.892 -0.595 . . . . 4.13 109.581 175.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -82.7 -27.53 31.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.745 0.783 . . . . 1.03 109.608 174.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.496 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 6.5 m -69.91 -52.48 24.27 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.627 -1.17 . . . . 0.48 109.515 172.096 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -66.47 -23.19 66.23 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.098 -0.955 . . . . 1.18 110.088 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.526 ' HA ' HG23 ' A' ' 87' ' ' VAL . 30.1 tt0 -55.45 -48.7 74.08 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.159 0.504 . . . . 0.8 110.739 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.537 ' OE1' HG21 ' B' 1004 ' ' VAL . 86.3 mt-30 -47.12 -29.78 2.44 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.528 -1.214 . . . . 1.62 111.748 176.119 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.673 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.0 t -90.35 -49.77 13.42 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.131 0 CA-C-N 115.121 -0.945 . . . . 1.3 110.199 -173.316 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.526 HG23 ' HA ' ' A' ' 84' ' ' GLU . 0.2 OUTLIER -52.45 -38.69 26.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 122.689 1.233 . . . . 0.85 108.878 177.129 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.452 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 4.4 m-80 -62.65 -43.89 97.65 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 112.652 -2.067 . . . . 0.91 112.16 -177.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 1.034 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.3 pp20? -67.71 -34.51 77.02 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 122.092 0.949 . . . . 2.87 108.967 177.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.612 HD13 ' OE2' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -66.9 -24.9 66.16 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-N 113.135 -1.848 . . . . 1.28 111.399 -165.729 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.783 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 4.7 p90 -108.49 -35.56 6.45 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 120.329 -0.548 . . . . 2.3 111.912 -172.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.452 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 10.3 ptm180 -75.31 -35.21 61.27 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.685 0.755 . . . . 5.06 110.675 -171.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.428 ' HB3' HH12 ' A' ' 99' ' ' ARG . 13.6 t70 -87.59 4.27 44.38 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.827 -1.079 . . . . 3.12 112.412 -169.431 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 129.67 70.13 0.12 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 117.375 -2.345 . . . . 2.31 115.505 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.783 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 64.5 t -69.94 99.22 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-O 122.613 1.197 . . . . 1.06 110.93 -179.168 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.584 ' OD1' ' HG2' ' A' ' 99' ' ' ARG . 5.3 p30 -107.45 -179.03 3.8 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 113.402 -1.726 . . . . 2.12 107.726 168.033 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.61 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 15.2 m-90 -49.7 -40.87 41.83 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 123.36 0.412 . . . . 3.34 111.569 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.553 ' HA3' HG21 ' B' 1015 ' ' ILE . . . -64.76 -41.01 97.8 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 114.574 0.59 . . . . 0.69 114.574 -175.224 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.584 ' HG2' ' OD1' ' A' ' 96' ' ' ASN . 13.9 mmt85 -58.79 -43.27 90.42 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.21 0.529 . . . . 4.24 111.123 -175.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 70.3 mt -68.89 -41.0 81.87 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.533 -0.758 . . . . 0.44 110.622 -176.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 97' ' ' TRP . 63.0 t -54.45 -54.58 20.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.024 -0.535 . . . . 1.35 109.856 171.308 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.412 ' HB2' ' CE1' ' A' ' 57' ' ' PHE . . . -52.33 -45.78 65.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.015 -0.993 . . . . 0.44 111.384 177.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.618 ' HZ ' ' HA ' ' A' ' 130' ' ' MET . 42.5 t80 -55.21 -39.63 69.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.749 . . . . 1.49 111.25 178.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 1.004 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 27.0 m-85 -78.47 -35.69 46.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.683 0.278 . . . . 3.29 111.116 177.457 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.74 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 23.1 m -63.69 -47.47 81.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.241 -0.436 . . . . 1.19 110.658 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.437 ' HE1' ' HB2' ' A' ' 65' ' ' PHE . 50.1 t80 -81.74 -29.29 32.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.022 -0.536 . . . . 2.89 110.618 -178.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.46 -47.72 61.3 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.769 -0.729 . . . . 0.3 111.285 175.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.952 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -64.92 -28.59 73.66 Favored Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 111.466 -0.654 . . . . 0.23 111.466 176.137 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.1 -32.75 61.51 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.295 -0.261 . . . . 0.31 110.295 176.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.402 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -68.29 -36.25 79.08 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-O 121.896 0.855 . . . . 1.12 109.494 -179.01 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.702 ' SG ' HG13 ' A' ' 123' ' ' VAL . 24.5 t -49.34 -50.88 37.8 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 113.77 -1.559 . . . . 0.26 109.579 171.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.526 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 96.4 t -67.27 -34.43 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 115.634 -0.712 . . . . 0.35 110.945 177.462 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.624 ' HB3' HG21 ' A' ' 74' ' ' ILE . 7.8 mm-40 -59.87 -28.98 68.0 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.388 0.614 . . . . 2.51 110.5 177.03 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.511 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 18.3 m -78.89 -39.61 34.53 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.347 -0.842 . . . . 0.28 109.082 177.085 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.648 HG23 ' O ' ' A' ' 111' ' ' CYS . 96.4 t -67.37 -34.66 70.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.985 0.898 . . . . 1.23 109.634 -177.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -54.78 -50.79 67.62 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.584 -1.644 . . . . 0.6 111.25 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 24.6 mmtt -86.33 12.75 9.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.717 -0.674 . . . . 1.62 110.055 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.39 52.07 4.98 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.87 0.843 . . . . 1.88 110.971 -178.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.558 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 25.9 mtm -125.74 44.52 2.81 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.394 -1.276 . . . . 0.31 107.883 178.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.46 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 1.6 mt-30 -60.02 -8.13 2.17 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.763 1.023 . . . . 1.15 113.763 -173.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.505 HG23 HD22 ' A' ' 122' ' ' LEU . 27.1 m -66.81 -24.5 32.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 O-C-N 122.008 -0.432 . . . . 0.46 110.904 175.394 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.789 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -71.3 -26.85 63.04 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 116.434 -0.348 . . . . 0.26 110.338 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.702 HG13 ' SG ' ' A' ' 111' ' ' CYS . 69.1 t -46.86 -54.64 2.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 123.576 0.548 . . . . 0.25 111.64 178.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.581 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 2.5 t -70.79 -29.57 65.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.738 0.304 . . . . 1.35 110.757 -179.161 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.789 ' HD2' HD13 ' A' ' 122' ' ' LEU . 73.8 mtt180 -69.31 -54.37 14.93 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.029 0.442 . . . . 2.67 110.436 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.595 HG22 ' SD ' ' A' ' 130' ' ' MET . 73.0 mt -56.01 -52.02 54.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.618 -0.719 . . . . 0.23 110.451 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.816 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.02 -33.73 69.27 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 120.889 0.376 . . . . 0.29 111.599 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.561 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -62.21 -62.31 1.86 Allowed 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 121.124 0.488 . . . . 0.28 110.379 176.283 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -62.07 -32.95 73.54 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.05 -0.977 . . . . 3.91 111.617 -175.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.618 ' HA ' ' HZ ' ' A' ' 103' ' ' PHE . 88.9 mtp -61.63 -53.57 54.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.981 0.419 . . . . 1.08 110.837 178.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.523 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -63.82 -39.07 93.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.046 -0.524 . . . . 0.25 110.982 179.399 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 86.3 m -63.66 -47.49 81.06 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.454 -0.339 . . . . 0.4 111.074 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.425 ' CE2' HG12 ' A' ' 87' ' ' VAL . 52.2 t80 -57.21 -39.69 75.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.506 -0.315 . . . . 3.13 110.403 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 1.004 HD12 ' HZ ' ' A' ' 104' ' ' PHE . 4.8 tt -58.32 -54.26 49.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.365 -0.976 . . . . 0.95 108.365 172.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -52.73 -46.31 67.35 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.229 -0.896 . . . . 0.46 112.194 -177.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -80.13 -59.19 2.81 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.319 0.58 . . . . 0.59 111.509 -176.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -92.62 -47.44 7.1 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 113.354 0.872 . . . . 1.45 113.354 -168.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.968 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -80.25 -43.35 21.52 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 113.502 0.927 . . . . 1.2 113.502 -166.636 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.665 ' HA ' HD12 ' A' ' 142' ' ' ILE . 32.9 tt0 -45.27 -53.11 18.65 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 112.919 0.711 . . . . 0.75 112.919 -175.101 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.54 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 19.6 Cg_endo -58.62 -45.29 30.66 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.693 1.595 . . . . 0.56 111.718 178.267 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -61.5 -42.58 99.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.419 -0.809 . . . . 1.2 110.547 178.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.665 HD12 ' HA ' ' A' ' 139' ' ' GLU . 28.1 mt -52.11 -49.16 40.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.876 -0.602 . . . . 0.32 110.83 174.42 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.621 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 71.1 mm-40 -63.06 -25.86 68.57 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.547 -0.751 . . . . 0.57 111.324 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.54 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.6 mm-40 -68.15 -22.27 64.86 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.447 0.641 . . . . 0.78 110.0 174.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ASN . . . . . 0.462 HD22 ' HA ' ' A' ' 96' ' ' ASN . 2.2 m-20 -105.03 4.08 31.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.149 -0.932 . . . . 0.93 109.785 -174.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 111.41 -43.28 1.75 Allowed Glycine 0 N--CA 1.442 -0.935 0 CA-C-N 115.385 -0.825 . . . . 0.56 112.437 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' GLY . . . . . 0.58 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 128.6 -176.88 18.08 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.368 -0.92 . . . . 0.49 112.808 178.284 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.631 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 8.5 m-90 -70.76 -38.48 73.46 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 122.683 0.393 . . . . 3.57 110.843 -178.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -61.35 -45.05 96.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.938 0.399 . . . . 1.96 110.197 178.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.545 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 93.4 m -59.13 -35.41 73.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.853 -0.612 . . . . 0.67 111.477 178.037 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.61 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 88.4 t80 -60.96 -42.01 97.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.802 0.335 . . . . 3.0 110.509 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.475 HG21 ' HB1' ' A' ' 45' ' ' ALA . 1.6 m -71.59 -25.09 24.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 1.15 110.27 179.037 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.487 ' HB2' ' O ' ' A' ' 150' ' ' THR . 19.2 mm-40 -62.19 -30.36 71.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.88 0.371 . . . . 1.67 110.33 171.409 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.7 mt -90.52 -62.05 1.54 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.135 -0.484 . . . . 1.3 110.941 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -123.64 29.65 6.5 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.451 0.643 . . . . 4.24 110.721 -175.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.54 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -58.16 165.81 7.03 Favored Glycine 0 CA--C 1.499 -0.917 0 CA-C-N 115.474 -0.785 . . . . 1.1 113.759 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.486 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 27.4 t-20 -64.38 109.77 2.03 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 113.888 -1.156 . . . . 1.29 110.837 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.699 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 9.5 m120 -82.71 -21.23 34.88 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.068 -0.514 . . . . 2.99 111.058 -178.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -54.42 -47.66 72.56 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.491 0.494 . . . . 2.52 110.829 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -81.15 -35.74 31.11 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.105 -0.498 . . . . 2.87 110.714 176.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.612 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -54.29 -59.81 4.17 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.08 -0.509 . . . . 3.2 111.628 -178.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.699 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 8.0 pt-20 -58.84 -33.89 70.93 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.622 0.249 . . . . 3.72 111.417 178.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 72.0 m -66.14 -36.17 82.43 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.933 0.397 . . . . 4.18 110.676 -178.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 26.7 mmm180 -80.14 -28.05 38.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.655 0.74 . . . . 5.82 109.822 175.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -74.33 -19.17 60.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.657 -1.156 . . . . 4.77 110.872 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -61.79 -37.5 94.41 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 121.066 -0.588 . . . . 5.1 112.491 -177.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -82.36 -23.89 34.79 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.29 0.566 . . . . 5.72 110.148 176.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -74.01 -8.41 56.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.714 -0.675 . . . . 5.88 110.185 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.549 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 0.4 OUTLIER -73.3 -38.31 65.91 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.608 -0.886 . . . . 7.34 108.608 176.96 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.499 HD22 ' HB3' ' A' ' 169' ' ' ARG . 2.8 mm? -95.65 -18.0 20.87 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.361 -0.836 . . . . 6.97 109.931 -179.016 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 65.76 179.5 0.2 Allowed 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.319 -0.855 . . . . 6.97 111.349 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 7.7 p80 -130.17 86.49 2.4 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 108.533 -0.914 . . . . 9.35 108.533 171.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -85.68 134.3 33.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.717 -1.129 . . . . 11.4 111.732 -169.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -95.96 164.1 12.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.584 -0.735 . . . . 11.52 109.306 175.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -95.08 86.63 4.66 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.079 0.466 . . . . 14.48 110.066 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 33.7 t-80 -94.27 -40.22 10.1 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.28 -0.637 . . . . 15.37 109.28 177.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -69.23 150.33 47.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.638 -0.71 . . . . 16.02 109.344 173.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 6.4 mp -91.98 160.19 15.37 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.786 0.327 . . . . 17.99 110.407 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -76.17 -21.05 56.98 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.358 0.599 . . . . 19.19 109.487 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 22.5 p80 -122.62 117.37 25.67 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.223 -0.899 . . . . 22.26 108.908 173.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -135.95 24.06 3.32 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.481 -0.327 . . . . 22.51 111.658 -177.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 46.7 m80 -74.6 86.93 2.13 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.282 -0.636 . . . . 24.89 109.282 172.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 32.7 t-80 -76.05 -24.55 55.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.092 -0.503 . . . . 25.58 110.383 -176.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 47.9 t-80 56.34 81.49 0.13 Allowed 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.68 -0.691 . . . . 27.37 109.87 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.134 -0.936 . . . . 29.06 109.843 -175.194 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.257 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -117.41 26.72 8.0 Favored Glycine 0 N--CA 1.448 -0.555 0 O-C-N 121.472 -0.768 . . . . 2.97 112.422 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.624 ' HB3' ' HE ' ' B' 1006 ' ' ARG . 68.9 m -106.06 86.35 2.36 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.008 0.432 . . . . 1.94 111.416 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.942 HG23 ' H ' ' B' 1005 ' ' GLY . 5.8 m -134.92 -77.94 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.367 0 CA-C-N 115.983 -0.553 . . . . 1.63 110.153 167.038 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 1005 ' ' GLY . . . . . 0.942 ' H ' HG23 ' B' 1004 ' ' VAL . . . -61.07 58.97 0.01 OUTLIER Glycine 0 CA--C 1.526 0.721 0 C-N-CA 121.265 -0.493 . . . . 1.2 113.293 169.109 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 1006 ' ' ARG . . . . . 0.883 ' HG3' ' C1 ' ' B' 1100 ' ' 33B . 0.0 OUTLIER -145.79 -29.56 0.42 Allowed 'General case' 0 C--O 1.215 -0.746 0 C-N-CA 122.787 0.435 . . . . 2.88 110.344 175.888 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B 1007 ' ' ALA . . . . . 0.833 ' H ' ' HD3' ' B' 1006 ' ' ARG . . . -120.33 -27.3 5.26 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-N 115.984 -0.553 . . . . 1.31 110.708 -176.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.422 ' HG ' HG13 ' A' ' 86' ' ' VAL . 2.7 mm? -61.02 -46.77 89.39 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 106.069 -1.826 . . . . 1.33 106.069 165.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 1009 ' ' ALA . . . . . 1.034 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -53.97 -56.9 13.53 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 113.629 -1.623 . . . . 0.88 111.832 167.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.775 ' HB3' ' HA ' ' B' 1007 ' ' ALA . . . -67.44 -54.33 21.2 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.165 -0.925 . . . . 1.03 112.908 -171.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.775 ' HE1' ' N10' ' B' 1100 ' ' 33B . 5.7 m-30 -66.0 -26.69 67.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.311 -0.404 . . . . 1.67 110.131 -176.241 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -87.5 1.01 85.64 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.662 -0.699 . . . . 0.78 113.458 -176.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 4.1 t70 -89.48 -3.21 58.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.162 0.506 . . . . 1.9 110.246 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 3.2 m -93.74 92.22 7.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.949 -0.568 . . . . 1.44 110.357 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.553 HG21 ' HA3' ' A' ' 98' ' ' GLY . 1.3 pp -140.83 37.62 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 112.059 0.392 . . . . 2.91 112.059 -178.737 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -109.28 104.65 13.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.255 -0.43 . . . . 4.29 110.032 176.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -114.54 98.16 6.72 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.818 -0.628 . . . . 8.17 110.272 -178.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.566 0 CA-C-N 116.485 -0.325 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.883 ' C1 ' ' HG3' ' B' 1006 ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.9 ptp . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 120.503 0.192 . . . . 6.21 111.187 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.7 m -100.04 137.98 37.74 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.773 0.32 . . . . 1.87 110.746 -176.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.1 mp0 -101.51 -8.85 21.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.349 0.595 . . . . 2.42 109.601 175.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.518 ' O ' HD13 ' A' ' 8' ' ' LEU . 1.5 p -68.66 -22.71 64.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.509 -0.769 . . . . 1.25 111.554 -178.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.517 ' HB3' HD22 ' A' ' 134' ' ' LEU . 3.1 p30 -62.72 -24.17 67.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.103 -0.499 . . . . 1.78 110.404 175.057 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.534 ' O ' HG23 ' A' ' 10' ' ' VAL . 3.9 tpp180 -61.53 -44.64 96.69 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.766 -0.652 . . . . 1.4 109.832 174.01 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.435 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 42.6 mt-10 -56.1 -57.85 10.4 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 115.554 -0.748 . . . . 0.68 110.166 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.518 HD13 ' O ' ' A' ' 4' ' ' SER . 5.8 mp -41.53 -50.25 4.01 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.647 -1.161 . . . . 1.16 111.098 178.035 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.472 HG21 ' N ' ' A' ' 131' ' ' ALA . 79.0 t -64.66 -59.5 4.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.51 -0.313 . . . . 0.27 111.04 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 6' ' ' ARG . 85.4 t -54.13 -48.14 65.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.135 -0.484 . . . . 0.33 112.122 -175.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -51.09 -43.83 61.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.93 -0.577 . . . . 0.59 110.808 -177.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.642 ' HB2' ' CE2' ' A' ' 104' ' ' PHE . 6.1 t80 -81.59 -41.34 21.69 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.19 -0.459 . . . . 1.61 111.679 -175.118 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 1.028 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 3.8 mp -60.46 -40.21 90.39 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 119.771 -0.772 . . . . 0.34 109.745 178.124 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.495 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 48.5 t -64.07 -46.5 84.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.673 -0.694 . . . . 1.05 110.067 175.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -60.36 -32.22 71.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.518 -0.764 . . . . 1.22 110.9 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.704 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 6.4 mmpt? -75.61 -33.19 60.51 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 111.839 0.311 . . . . 1.41 111.839 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.606 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -62.22 -27.72 69.19 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.736 -0.786 . . . . 1.35 109.788 175.163 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.9 t -65.61 -30.33 71.04 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.379 -0.828 . . . . 0.94 112.219 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.704 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 13.4 pt20 -74.92 -9.24 58.36 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.773 0.657 . . . . 1.37 112.773 -172.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.785 ' NZ ' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -119.24 -19.94 8.14 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 121.918 0.866 . . . . 2.2 109.549 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.51 26.4 6.89 Favored Glycine 0 C--N 1.306 -1.086 0 CA-C-N 113.945 -1.48 . . . . 0.53 113.058 173.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -104.98 171.23 7.43 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.612 0.244 . . . . 0.76 110.555 170.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.6 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 8.3 t -110.67 157.63 19.51 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.104 0.478 . . . . 0.52 110.861 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.534 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 65.6 t-105 -75.92 -52.05 11.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.516 -0.766 . . . . 3.36 110.172 174.041 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m -67.21 -19.91 65.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.579 -0.737 . . . . 1.37 111.685 -174.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.6 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 51.3 mt-30 -51.93 -38.7 57.36 Favored 'General case' 0 N--CA 1.461 0.092 0 N-CA-C 111.793 0.294 . . . . 1.11 111.793 177.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -121.93 -4.15 9.11 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.831 0.678 . . . . 1.28 112.831 -178.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.638 ' HB3' HG22 ' A' ' 30' ' ' VAL . 19.8 m -102.16 149.23 24.49 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 122.026 0.917 . . . . 1.81 112.094 -178.062 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -124.37 -1.71 8.09 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 113.594 -1.639 . . . . 2.31 109.015 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.863 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.6 m -58.75 -73.7 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 113.889 -1.505 . . . . 0.92 112.801 -168.29 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.863 ' H ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -90.73 0.06 57.54 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.481 0.658 . . . . 2.74 109.868 177.262 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -72.56 -44.92 61.45 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 114.774 -1.103 . . . . 1.45 110.857 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -103.03 -31.59 10.12 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.961 -0.563 . . . . 1.87 111.435 -174.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.606 ' O ' ' HA ' ' A' ' 31' ' ' GLU . 51.3 ptt85 -137.22 155.13 49.89 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.327 -0.397 . . . . 3.39 110.322 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.9 p -137.43 112.54 9.11 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.304 0.574 . . . . 2.25 111.175 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -80.52 -72.15 0.43 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.603 -0.726 . . . . 3.34 110.19 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -95.42 148.07 34.03 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.717 -0.674 . . . . 1.92 109.823 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.518 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 71.5 Cg_exo -51.39 163.35 1.08 Allowed 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 123.317 2.678 . . . . 1.87 112.574 174.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -70.01 -2.8 13.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.402 -0.363 . . . . 4.64 111.841 -178.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 175.54 63.65 0.06 OUTLIER Glycine 0 N--CA 1.443 -0.853 0 C-N-CA 120.833 -0.699 . . . . 2.15 111.967 175.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.699 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -75.8 -75.51 0.18 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.424 -0.51 . . . . 1.12 110.28 -177.729 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.699 ' H ' HG23 ' A' ' 41' ' ' THR . 14.3 pt-20 -93.85 -31.24 14.42 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.011 0.91 . . . . 2.02 109.892 173.29 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.747 ' HA ' HG13 ' A' ' 46' ' ' VAL . 57.7 m -63.66 -25.11 68.07 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 113.653 -1.612 . . . . 1.25 113.261 -170.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -40.12 -50.8 2.65 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 123.613 0.571 . . . . 1.91 112.314 -173.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.82 -40.05 41.75 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.931 -0.308 . . . . 0.52 111.652 176.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.747 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.9 m -65.12 -46.13 92.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 121.284 -0.166 . . . . 1.41 111.381 -176.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.744 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.8 ptpt -68.34 -40.27 81.64 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.457 -0.571 . . . . 0.67 109.457 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.48 ' OE1' ' HD2' ' A' ' 51' ' ' ARG . 8.0 mm-40 -58.34 -38.4 77.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.414 -0.812 . . . . 0.99 111.086 174.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.5 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -72.06 -41.57 67.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.4 0.619 . . . . 0.42 110.981 176.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.546 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.1 tp -65.98 -24.83 66.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.318 -0.856 . . . . 1.33 112.087 -174.083 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.505 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 7.6 ptp180 -85.63 -25.91 26.34 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 121.705 0.764 . . . . 2.17 109.491 -177.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.821 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 7.5 mm-40 -69.57 -47.54 63.26 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.705 -1.134 . . . . 1.1 109.282 173.025 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' A' ' 56' ' ' GLU . . . -66.81 -33.19 75.07 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.084 -0.962 . . . . 0.53 110.173 174.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.655 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -59.06 -46.44 93.74 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.371 -0.692 . . . . 0.7 111.371 176.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.652 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 30.4 t70 -63.26 -37.29 86.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.963 0.411 . . . . 1.04 110.283 176.792 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.485 ' O ' HD11 ' A' ' 59' ' ' LEU . 14.6 tp10 -60.48 -28.15 68.12 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.34 -0.845 . . . . 2.29 110.469 176.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.693 ' HZ ' ' HB3' ' B' 1008 ' ' LEU . 49.8 t80 -81.9 -46.56 13.9 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.322 -0.854 . . . . 2.29 110.771 174.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.747 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 46.3 mt-10 -60.13 -57.67 11.8 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.504 -0.771 . . . . 1.3 112.76 -170.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.705 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -43.32 -41.47 4.06 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.853 1.057 . . . . 1.54 113.853 -172.851 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.705 ' H ' HD12 ' A' ' 59' ' ' LEU . 72.5 mtt85 -67.81 -45.71 73.96 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.011 0.374 . . . . 2.58 112.011 -175.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.747 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 5.0 p90 -92.42 -3.87 54.59 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.731 -0.213 . . . . 5.32 111.159 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.9 tpp180 -43.36 -49.52 6.94 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.361 0.664 . . . . 4.48 112.578 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -67.21 -13.51 62.03 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.209 0.448 . . . . 4.72 112.209 -175.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.487 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -92.14 -26.6 18.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.842 0.312 . . . . 1.17 111.842 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.613 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 81.3 t80 -48.96 -46.45 43.48 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.078 0.77 . . . . 2.81 113.078 -170.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.8 t -68.03 -40.14 82.96 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.913 0.387 . . . . 2.19 110.896 -175.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -71.2 -39.45 71.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.049 -0.523 . . . . 2.72 111.006 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.487 HD13 ' O ' ' A' ' 64' ' ' ALA . 3.7 mp -64.81 -20.46 66.4 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 113.211 0.819 . . . . 1.56 113.211 -171.121 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.528 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 3.2 p -57.45 -35.49 70.19 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.064 0.847 . . . . 0.7 111.16 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.0 t -71.93 -25.36 61.86 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.54 -0.754 . . . . 1.34 109.528 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.48 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 36.7 mt-30 -83.82 -38.01 21.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.223 -0.898 . . . . 1.42 110.133 -178.524 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.583 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.8 mm? -65.96 -32.99 74.8 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.734 -0.469 . . . . 1.37 109.734 170.294 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.433 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 50.6 m80 68.16 41.77 1.89 Allowed 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.144 -1.058 . . . . 2.72 108.144 -173.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.583 HG12 ' HB2' ' A' ' 72' ' ' LEU . 28.0 mm -50.44 117.15 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 113.322 -1.763 . . . . 0.91 111.931 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.761 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.46 -171.48 0.28 Allowed Pre-proline 0 N--CA 1.441 -0.913 0 N-CA-C 107.43 -1.322 . . . . 0.51 107.43 -173.097 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.761 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.7 Cg_exo -28.86 166.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 125.017 3.811 . . . . 0.47 115.355 164.268 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.527 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -29.09 -28.75 0.01 OUTLIER Glycine 0 N--CA 1.472 1.074 0 N-CA-C 117.937 1.935 . . . . 0.4 117.937 -170.488 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.471 ' N ' ' O ' ' A' ' 76' ' ' PRO . 41.7 p -66.72 5.8 0.57 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 118.31 1.055 . . . . 0.56 112.339 -178.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.9 -12.43 61.61 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.975 0.417 . . . . 0.34 110.096 174.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.527 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 10.4 p90 -76.33 -17.3 59.49 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.427 0.632 . . . . 4.13 109.349 174.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.436 ' HB2' ' O ' ' A' ' 78' ' ' THR . 35.7 mt-30 -84.91 -20.02 31.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.101 -0.954 . . . . 1.03 109.698 174.015 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.0 m -82.04 -53.28 6.25 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.531 -1.213 . . . . 0.48 109.667 173.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.551 ' HA ' HG23 ' A' ' 86' ' ' VAL . 78.3 t80 -63.09 -16.68 60.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.326 -0.852 . . . . 1.18 110.111 174.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.526 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.3 tt0 -54.68 -50.23 68.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.205 -0.907 . . . . 0.8 110.374 173.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -49.94 -32.15 14.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.986 -1.006 . . . . 1.62 110.888 177.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.883 HG13 HD12 ' B' 1008 ' ' LEU . 1.8 t -80.93 -53.49 12.31 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-N 114.733 -1.121 . . . . 1.3 110.443 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.526 HG12 ' HA ' ' A' ' 84' ' ' GLU . 8.9 p -60.98 -23.55 30.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.815 0.817 . . . . 0.85 109.337 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.6 m-80 -78.06 -38.87 43.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.338 -1.301 . . . . 0.91 112.089 176.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 1.114 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.0 OUTLIER -73.84 -32.38 63.65 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.343 -0.984 . . . . 2.87 108.343 178.805 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.676 HD13 ' OE1' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -67.61 -44.02 79.06 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.553 -1.203 . . . . 1.28 110.233 -174.059 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.407 ' CD1' ' HA ' ' A' ' 88' ' ' ASN . 0.4 OUTLIER -99.14 10.18 41.96 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.496 -0.774 . . . . 2.3 111.066 -169.802 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.862 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.09 -23.47 66.54 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.108 -0.496 . . . . 5.06 110.542 178.301 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -96.44 -31.11 12.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 122.068 0.937 . . . . 3.12 109.186 169.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.59 ' O ' HG23 ' A' ' 95' ' ' VAL . . . 130.79 -42.1 1.44 Allowed Glycine 0 C--N 1.312 -0.79 0 CA-C-N 113.862 -1.517 . . . . 2.31 113.234 165.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.649 HG21 HD22 ' A' ' 138' ' ' LEU . 1.6 t 168.2 131.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 C-N-CA 125.079 1.352 . . . . 1.06 110.582 157.084 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.643 ' H ' ' CB ' ' A' ' 99' ' ' ARG . 2.0 m120 -111.16 170.07 8.35 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.387 -0.824 . . . . 2.12 109.313 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.554 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 16.9 m-90 -54.76 -58.05 9.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.933 0.396 . . . . 3.34 110.713 175.115 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.564 ' HA3' ' HB ' ' B' 1015 ' ' ILE . . . -70.2 -13.94 70.79 Favored Glycine 0 CA--C 1.518 0.272 0 CA-C-N 115.93 -0.577 . . . . 0.69 112.689 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.643 ' CB ' ' H ' ' A' ' 96' ' ' ASN . 18.2 tpp180 -69.35 -43.2 74.1 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.078 0.466 . . . . 4.24 110.97 -176.767 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 90.2 mt -64.67 -40.26 88.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.731 -0.668 . . . . 0.44 110.547 -178.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.551 ' O ' ' HD1' ' A' ' 104' ' ' PHE . 0.5 OUTLIER -63.97 -38.19 81.76 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 CA-C-N 116.204 -0.453 . . . . 1.35 110.322 175.592 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.1 -46.44 89.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.354 0.597 . . . . 0.44 110.217 176.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -58.22 -50.0 75.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.81 -1.087 . . . . 1.49 111.284 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.642 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -76.49 -20.04 57.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.808 0.337 . . . . 3.29 110.948 -176.32 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.617 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 37.3 t -75.67 -55.98 5.13 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.261 -0.427 . . . . 1.19 110.304 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.431 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 31.4 t80 -66.49 -26.66 67.28 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 109.448 -0.575 . . . . 2.89 109.448 179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.57 ' HA3' ' HE1' ' A' ' 130' ' ' MET . . . -65.11 -38.53 95.42 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 121.09 -0.576 . . . . 0.3 111.735 174.036 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 1.028 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -68.77 -35.4 79.93 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.587 -0.816 . . . . 0.23 111.076 174.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.613 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -67.81 -33.3 74.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.366 -0.417 . . . . 0.31 110.627 176.042 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.447 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -60.93 -37.42 82.25 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 122.221 1.01 . . . . 1.12 108.708 -178.854 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.66 ' HB2' HD23 ' A' ' 13' ' ' LEU . 35.3 t -58.69 -53.74 54.98 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.038 -1.437 . . . . 0.26 110.148 174.481 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.785 HG13 ' NZ ' ' A' ' 20' ' ' LYS . 80.7 t -60.18 -40.79 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 116.619 -0.264 . . . . 0.35 110.914 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.528 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 35.6 mt-10 -54.45 -38.22 66.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.011 0.434 . . . . 2.51 110.611 176.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 48.0 m -74.38 -38.78 63.06 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.491 0.663 . . . . 0.28 109.543 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.646 ' HA ' ' HG2' ' A' ' 120' ' ' GLN . 92.0 t -69.31 -30.31 45.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.114 -0.948 . . . . 1.23 109.783 -177.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.81 -49.79 74.32 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 113.641 -1.618 . . . . 0.6 111.027 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 25.8 mmtt -87.4 11.96 13.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.439 -0.801 . . . . 1.62 110.278 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 61.32 50.9 4.49 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 122.044 0.926 . . . . 1.88 110.556 -178.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.608 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 24.3 mtm -125.63 46.91 2.3 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.255 -1.339 . . . . 0.31 107.565 176.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.646 ' HG2' ' HA ' ' A' ' 115' ' ' VAL . 27.8 mt-30 -68.44 -5.79 21.19 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.083 -0.962 . . . . 1.15 111.142 -172.472 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.636 HG23 HD22 ' A' ' 122' ' ' LEU . 25.8 m -58.02 -24.65 24.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 122.142 -0.349 . . . . 0.46 110.895 172.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.704 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.0 mm? -76.06 -26.8 56.9 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.481 -0.327 . . . . 0.26 110.391 178.47 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.615 HG22 ' SG ' ' A' ' 111' ' ' CYS . 78.8 t -45.63 -57.62 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 O-C-N 123.806 0.691 . . . . 0.25 111.707 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -21.45 57.62 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.787 -0.642 . . . . 1.35 111.639 -176.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.704 ' HD2' HD13 ' A' ' 122' ' ' LEU . 86.7 mtt180 -72.35 -58.22 3.57 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.924 -0.58 . . . . 2.67 110.385 175.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.636 ' HA ' ' CE2' ' A' ' 129' ' ' TRP . 86.9 mt -48.25 -49.41 12.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.426 -0.806 . . . . 0.23 111.595 -176.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.534 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -59.64 -26.3 65.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.09 0.404 . . . . 0.29 112.09 -177.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.18 -65.13 0.71 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.496 0.665 . . . . 0.28 110.046 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.636 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 38.7 p-90 -75.16 -17.85 60.31 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.04 -0.982 . . . . 3.91 111.747 -175.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.57 ' HE1' ' HA3' ' A' ' 107' ' ' GLY . 13.3 mmm -62.21 -57.67 10.59 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 120.967 0.413 . . . . 1.08 110.248 170.399 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.472 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -64.0 -38.29 90.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.883 -0.598 . . . . 0.25 110.538 179.014 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.516 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 89.1 m -60.78 -43.56 97.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.399 -0.364 . . . . 0.4 111.534 176.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -60.88 -39.9 90.99 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.775 -0.454 . . . . 3.13 109.775 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.517 HD22 ' HB3' ' A' ' 5' ' ' ASN . 5.4 tt -62.18 -50.87 70.1 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.603 -0.888 . . . . 0.95 108.603 173.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -48.69 -56.74 7.69 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.977 -0.556 . . . . 0.46 112.41 179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -78.06 -49.74 13.4 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.043 0.449 . . . . 0.59 111.88 -174.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -91.3 -50.81 5.61 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 112.788 0.662 . . . . 1.45 112.788 -169.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.649 HD22 HG21 ' A' ' 95' ' ' VAL . 53.7 mt -86.29 -34.68 20.28 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 112.729 0.64 . . . . 1.2 112.729 -166.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.627 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 21.0 tt0 -49.84 -51.39 61.09 Favored Pre-proline 0 CA--C 1.539 0.545 0 O-C-N 123.198 0.311 . . . . 0.75 111.707 -174.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.589 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 24.6 Cg_exo -63.42 -43.3 18.32 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 121.934 1.756 . . . . 0.56 111.951 176.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 5.6 t-105 -59.45 -47.35 85.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.418 -0.81 . . . . 1.2 110.223 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.579 HG22 ' HA2' ' A' ' 147' ' ' GLY . 37.4 mt -48.39 -51.58 10.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.592 -0.731 . . . . 0.32 111.095 174.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.627 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 70.1 mm-40 -57.15 -35.25 69.29 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.718 -0.673 . . . . 0.57 111.303 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 9.5 mm-40 -64.8 -21.54 66.8 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.437 0.637 . . . . 0.78 111.307 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ASN . . . . . 0.41 ' HB3' ' NE1' ' A' ' 97' ' ' TRP . 16.2 m-80 -110.65 9.21 22.91 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.256 -0.884 . . . . 0.93 110.105 -174.372 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 116.43 -47.52 1.03 Allowed Glycine 0 N--CA 1.441 -1.029 0 CA-C-N 114.78 -1.1 . . . . 0.56 112.704 174.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' GLY . . . . . 0.579 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 132.01 -177.24 18.82 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.761 -0.733 . . . . 0.49 111.961 -177.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.608 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 13.6 m-90 -71.01 -37.95 72.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.019 0.438 . . . . 3.57 110.258 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.605 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 6.2 m-20 -64.07 -31.49 72.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.638 -0.71 . . . . 1.96 110.339 178.111 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.593 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 87.0 m -67.34 -40.04 85.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.068 -0.515 . . . . 0.67 111.508 179.348 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.554 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 85.3 t80 -64.72 -31.06 72.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.797 0.808 . . . . 3.0 109.104 -178.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.605 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 87.4 t -59.67 -50.24 80.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 114.422 -1.263 . . . . 1.15 110.35 172.149 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.79 -28.45 64.01 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.829 -1.078 . . . . 1.67 111.518 176.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 150' ' ' THR . 10.2 mt -86.37 -56.13 3.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.458 -0.337 . . . . 1.3 111.26 -177.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -115.11 -44.25 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.871 -0.332 . . . . 4.24 110.461 -178.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.5 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . 50.86 -160.17 1.61 Allowed Glycine 0 CA--C 1.509 -0.343 0 CA-C-O 121.813 0.674 . . . . 1.1 114.597 178.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.821 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 23.9 t-20 -110.56 117.38 33.38 Favored 'General case' 0 N--CA 1.433 -1.289 0 CA-C-N 114.37 -0.915 . . . . 1.29 110.197 -177.308 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.73 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 19.0 m120 -93.46 -12.5 29.59 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.562 -0.29 . . . . 2.99 110.668 -178.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -52.42 -53.92 38.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.862 -0.608 . . . . 2.52 110.529 176.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -86.0 -34.28 20.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.124 -0.489 . . . . 2.87 111.025 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.73 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -56.08 -60.33 3.63 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.462 -0.335 . . . . 3.2 111.827 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -69.42 -21.82 63.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.912 0.387 . . . . 3.72 110.901 -177.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 15.9 t -74.43 -30.17 61.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.229 0.538 . . . . 4.18 110.011 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -86.05 -17.36 35.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.496 0.665 . . . . 5.82 109.88 178.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -67.1 -18.46 65.32 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.89 -1.05 . . . . 4.77 111.313 -177.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -57.24 -44.73 93.22 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 121.109 -0.567 . . . . 5.1 113.028 -176.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -69.52 -24.12 63.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.816 0.341 . . . . 5.72 110.823 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.587 ' HA ' ' O ' ' A' ' 171' ' ' GLU . 40.2 mt-10 -75.5 -0.31 19.78 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.154 -0.475 . . . . 5.88 111.193 -179.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.513 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 2.5 tmt_? -78.25 -33.56 49.61 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.278 -1.008 . . . . 7.34 108.278 173.409 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -95.88 -37.89 10.51 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.506 -0.77 . . . . 6.97 110.026 178.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 171' ' ' GLU . . . . . 0.587 ' O ' ' HA ' ' A' ' 168' ' ' GLU . 31.6 mt-10 -105.36 103.23 12.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.727 -0.67 . . . . 6.97 110.054 177.628 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -81.37 125.79 30.82 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.448 -0.342 . . . . 9.35 110.523 -176.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -55.59 119.72 6.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.783 -0.644 . . . . 11.4 110.4 178.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 33.3 p-80 -132.58 95.68 3.67 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.522 0.677 . . . . 11.52 110.909 -177.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -121.77 -29.0 4.41 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.37 -0.832 . . . . 14.48 109.169 174.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 176' ' ' HIS . . . . . 0.459 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 0.9 OUTLIER -154.54 145.02 22.18 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.336 -0.987 . . . . 15.37 108.336 177.481 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 33.7 m80 -64.89 -27.06 68.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.79 0.329 . . . . 16.02 110.555 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 176' ' ' HIS . 95.9 mt 74.61 -20.39 0.33 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.473 -0.785 . . . . 17.99 112.208 171.187 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 179' ' ' GLU . . . . . 0.428 ' C ' ' H ' ' A' ' 181' ' ' HIS . 33.4 tt0 65.68 -85.68 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 O-C-N 123.713 0.633 . . . . 19.19 110.602 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 24.7 t-80 70.95 -14.49 0.44 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.259 0.624 . . . . 22.26 111.941 173.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 181' ' ' HIS . . . . . 0.428 ' H ' ' C ' ' A' ' 179' ' ' GLU . 21.9 p-80 -152.91 156.29 38.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.392 -0.367 . . . . 22.51 110.022 179.165 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -65.03 150.44 48.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.167 -0.469 . . . . 24.89 111.536 -177.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 47.3 m-70 -87.5 157.9 19.07 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.854 -0.612 . . . . 25.58 109.598 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -71.6 -48.27 49.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.103 0.478 . . . . 27.37 110.137 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 66.2 m-70 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.71 -0.662 . . . . 29.06 109.697 177.558 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.156 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B 1002 ' ' GLY . . . . . 0.544 ' O ' HG22 ' B' 1004 ' ' VAL . . . 115.68 159.76 12.19 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.903 -0.665 . . . . 2.97 111.958 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 1003 ' ' CYS . . . . . . . . . . . . . 13.4 m 56.93 -141.95 0.77 Allowed 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 122.432 0.293 . . . . 1.94 110.69 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.854 ' HA ' ' HG ' ' B' 1008 ' ' LEU . 15.7 m 37.29 -88.95 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 124.821 1.249 . . . . 1.63 113.953 173.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 1005 ' ' GLY . . . . . 0.828 ' H ' HG23 ' B' 1004 ' ' VAL . . . -35.38 -33.21 0.04 OUTLIER Glycine 0 C--N 1.349 1.258 0 CA-C-N 118.161 0.437 . . . . 1.2 114.026 168.483 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 1006 ' ' ARG . . . . . 0.448 ' HA ' ' HD3' ' B' 1006 ' ' ARG . 26.2 mmt180 -102.63 -48.5 4.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.951 0.405 . . . . 2.88 111.125 174.464 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 1007 ' ' ALA . . . . . 0.474 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -63.23 -53.88 46.06 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.913 0.709 . . . . 1.31 112.913 -169.463 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.883 HD12 HG13 ' A' ' 86' ' ' VAL . 3.1 mt -72.55 -40.41 66.72 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.335 -0.617 . . . . 1.33 109.335 -171.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 1009 ' ' ALA . . . . . 1.114 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -47.73 -49.97 26.63 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 122.212 1.006 . . . . 0.88 109.92 169.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.866 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -69.14 -49.42 57.09 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 113.82 -1.537 . . . . 1.03 111.997 -175.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.693 ' CZ ' ' H8 ' ' B' 1100 ' ' 33B . 28.7 m-85 -68.4 -23.76 64.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.238 -0.437 . . . . 1.67 111.161 -176.652 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -68.18 -23.81 74.72 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 116.062 -0.517 . . . . 0.78 113.639 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.62 -2.87 12.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.274 0.472 . . . . 1.9 112.274 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 32.8 m -109.59 7.71 24.68 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 111.901 0.334 . . . . 1.44 111.901 -178.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.564 ' HB ' ' HA3' ' A' ' 98' ' ' GLY . 42.1 mt -94.36 78.4 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.984 0.421 . . . . 2.91 111.097 -177.652 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -168.8 141.4 2.78 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.131 -0.692 . . . . 4.29 109.131 176.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 6.0 tpp180 -117.09 -78.17 0.58 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.822 0.344 . . . . 8.17 110.457 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 116.721 -0.218 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.866 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 mmt . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 120.423 0.154 . . . . 6.21 110.852 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.0 m -80.56 151.41 29.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.865 0.364 . . . . 1.87 111.151 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 -97.18 -6.27 35.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.579 0.704 . . . . 2.42 109.707 178.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.434 ' HB3' ' OG ' ' A' ' 43' ' ' SER . 1.4 m -64.64 -26.47 68.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.071 -0.968 . . . . 1.25 112.208 -174.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.619 ' HB2' HD13 ' A' ' 134' ' ' LEU . 5.2 p30 -66.39 -28.56 68.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.674 0.274 . . . . 1.78 111.483 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.588 ' O ' HG23 ' A' ' 10' ' ' VAL . 7.2 tpp180 -56.99 -46.14 82.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.021 -0.536 . . . . 1.4 110.113 177.478 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.759 ' OE1' ' HA2' ' A' ' 40' ' ' GLY . 44.1 mt-10 -55.18 -49.71 71.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.123 -0.944 . . . . 0.68 111.367 -178.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.519 HD21 ' CB ' ' A' ' 43' ' ' SER . 9.0 mt -58.7 -35.83 73.27 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.936 -1.029 . . . . 1.16 110.271 -173.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.481 HG11 ' O ' ' A' ' 127' ' ' ALA . 75.8 t -70.97 -58.94 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.558 -0.747 . . . . 0.27 109.985 174.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 6' ' ' ARG . 86.5 t -52.88 -55.62 11.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.864 -1.062 . . . . 0.33 112.243 -174.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.42 -36.35 71.24 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.142 -0.481 . . . . 0.59 110.385 -177.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.689 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 5.7 t80 -70.45 -49.38 49.24 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.847 -0.615 . . . . 1.61 110.573 -178.49 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.993 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.0 mp -62.11 -38.64 89.66 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 120.558 -0.457 . . . . 0.34 110.489 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.433 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 28.6 t -55.65 -46.34 77.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.883 -0.599 . . . . 1.05 110.403 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.411 ' HD2' ' HZ1' ' A' ' 16' ' ' LYS . 38.6 t80 -69.04 -29.07 67.14 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.896 -0.593 . . . . 1.22 110.85 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.636 ' HG2' ' O ' ' A' ' 12' ' ' PHE . 10.0 mmpt? -71.71 -37.42 70.66 Favored 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 121.057 -0.257 . . . . 1.41 110.709 -179.06 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.487 HD21 ' SG ' ' A' ' 111' ' ' CYS . 0.2 OUTLIER -66.64 -30.73 71.06 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.943 -0.391 . . . . 1.35 109.943 174.761 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.0 t -64.05 -25.55 68.16 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.978 -0.556 . . . . 0.94 111.451 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -72.68 -18.53 61.54 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.863 0.84 . . . . 1.37 110.095 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.54 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 19.0 mmmt -104.83 -26.36 12.26 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.249 -1.341 . . . . 2.2 109.281 -175.595 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.35 26.53 7.7 Favored Glycine 0 N--CA 1.438 -1.193 0 CA-C-N 113.815 -1.539 . . . . 0.53 111.433 178.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.666 ' HB3' ' HE2' ' A' ' 27' ' ' PHE . 96.0 m-85 -115.46 166.82 11.46 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.335 -0.432 . . . . 0.76 110.298 177.593 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.9 t -110.8 145.76 37.59 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.274 -0.421 . . . . 0.52 110.632 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 1.7 t90 -68.88 -49.99 53.52 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.248 -0.433 . . . . 3.36 109.897 174.42 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.8 p -61.77 -37.46 84.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.642 -0.708 . . . . 1.37 111.45 -173.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -58.88 -28.75 66.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.209 -0.451 . . . . 1.11 111.477 178.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.666 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 17.4 m-85 -117.04 16.31 15.04 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.035 0.445 . . . . 1.28 110.726 -175.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.61 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 78.9 p -100.46 179.52 4.42 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.4 0.619 . . . . 1.81 111.814 -174.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.611 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 14.3 t70 -167.05 -13.17 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.399 -1.273 . . . . 2.31 108.515 -178.405 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.931 HG23 ' H ' ' A' ' 31' ' ' GLU . 9.0 m -67.48 -72.0 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.232 -1.349 . . . . 0.92 111.707 179.085 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.931 ' H ' HG23 ' A' ' 30' ' ' VAL . 28.4 mm-40 -94.48 2.54 55.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.846 -0.798 . . . . 2.74 108.846 177.091 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.611 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 6.2 tt0 -61.17 -68.48 0.31 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.8 -1.091 . . . . 1.45 111.084 -177.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.418 ' ND2' ' H ' ' A' ' 33' ' ' ASN . 2.4 p30 -87.16 -35.11 18.79 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.732 -0.667 . . . . 1.87 111.268 -175.054 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.449 ' O ' ' HA ' ' A' ' 31' ' ' GLU . 10.0 ptt180 -112.78 139.93 47.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.893 -0.594 . . . . 3.39 110.409 178.16 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 19.8 p -107.72 114.3 28.17 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.186 0.517 . . . . 2.25 110.481 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -117.32 -60.71 1.8 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.721 -0.672 . . . . 3.34 111.098 -175.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.461 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . . . -71.36 139.91 84.63 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.596 -0.729 . . . . 1.92 110.967 177.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.555 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 13.1 Cg_exo -70.16 178.0 5.27 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 123.145 2.564 . . . . 1.87 111.4 174.235 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -74.39 -9.78 58.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.652 0.739 . . . . 4.64 110.216 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.759 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 151.5 66.76 0.01 OUTLIER Glycine 0 N--CA 1.439 -1.163 0 CA-C-N 115.215 -0.902 . . . . 2.15 111.124 -178.005 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.884 HG23 ' H ' ' A' ' 42' ' ' GLU . 2.6 t -63.55 -73.64 0.11 Allowed 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 120.345 -0.542 . . . . 1.12 109.931 -174.29 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.884 ' H ' HG23 ' A' ' 41' ' ' THR . 14.5 pt-20 -93.32 -31.66 14.59 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.618 1.199 . . . . 2.02 108.631 166.378 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . 1.002 ' HA ' HG13 ' A' ' 46' ' ' VAL . 39.4 m -68.94 -17.21 63.92 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 113.071 -1.877 . . . . 1.25 114.68 -167.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.43 ' HB2' ' HA3' ' A' ' 40' ' ' GLY . 45.1 tt0 -52.82 -39.82 62.76 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 118.439 0.563 . . . . 1.91 111.001 -178.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -82.08 -40.38 22.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.592 -0.276 . . . . 0.52 111.205 176.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 1.002 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.8 m -69.43 -36.95 74.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.896 -0.321 . . . . 1.41 111.313 -175.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -71.27 -34.94 71.15 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 108.776 -0.824 . . . . 0.67 108.776 178.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.659 HE22 HH11 ' A' ' 51' ' ' ARG . 19.1 mm-40 -64.21 -32.88 74.63 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.161 -0.927 . . . . 0.99 110.42 177.388 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.682 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -77.42 -42.44 36.13 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.886 -0.597 . . . . 0.42 110.779 175.511 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.498 HD12 ' CE2' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -66.51 -23.13 66.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.001 -0.545 . . . . 1.33 112.242 -176.387 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.659 HH11 HE22 ' A' ' 48' ' ' GLN . 16.2 ptm180 -78.12 -29.13 48.72 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 107.863 -1.162 . . . . 2.17 107.863 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.946 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 6.6 mm-40 -74.42 -52.13 12.93 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 113.565 -1.652 . . . . 1.1 109.835 177.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.07 -44.39 92.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.823 -0.626 . . . . 0.53 111.025 178.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.58 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.86 -36.04 92.84 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 121.045 -0.598 . . . . 0.7 111.984 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -64.33 -37.11 86.34 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 110.34 -0.245 . . . . 1.04 110.34 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.534 ' HA ' HD11 ' A' ' 59' ' ' LEU . 24.3 mm-40 -60.5 -27.06 67.3 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.544 0.528 . . . . 2.29 111.292 177.214 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.579 ' HD2' ' HB3' ' A' ' 105' ' ' SER . 36.8 t80 -80.33 -26.4 38.77 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.986 0.422 . . . . 2.29 110.271 175.307 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.58 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 46.4 mt-10 -67.94 -60.78 2.24 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.933 -0.576 . . . . 1.3 111.951 -174.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.612 HD22 ' N ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -55.71 -33.76 64.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 118.18 0.445 . . . . 1.54 110.995 -178.992 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.612 ' N ' HD22 ' A' ' 59' ' ' LEU . 59.7 mtt180 -60.22 -62.65 1.71 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.759 -0.655 . . . . 2.58 112.049 172.333 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -92.71 -2.98 55.58 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.339 0.866 . . . . 5.32 113.339 -168.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.868 ' HA ' ' CE2' ' A' ' 65' ' ' PHE . 32.6 ttt180 -52.81 -45.61 67.31 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.895 0.702 . . . . 4.48 112.895 -171.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -69.56 -14.04 62.64 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.964 -0.294 . . . . 4.72 111.212 -178.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.664 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.35 -60.77 1.84 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.012 0.375 . . . . 1.17 112.012 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.89 ' HA ' HD11 ' A' ' 68' ' ' LEU . 4.9 p90 -57.88 -29.45 65.04 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.751 1.019 . . . . 2.81 113.751 -167.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.3 t -90.74 -11.33 39.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.312 0.577 . . . . 2.19 110.43 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -90.8 -50.97 5.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.779 0.8 . . . . 2.72 110.413 -177.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.984 HD13 HD11 ' A' ' 72' ' ' LEU . 0.4 OUTLIER -67.44 -4.29 10.85 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.357 -1.292 . . . . 1.56 114.4 -174.372 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.803 ' HA ' HD13 ' A' ' 72' ' ' LEU . 3.2 p -45.78 -23.75 0.3 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 118.779 0.718 . . . . 0.7 112.86 -171.515 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 73.7 m -46.48 -60.15 2.53 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.1 0.56 . . . . 1.34 111.508 166.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.454 ' CD ' ' H ' ' A' ' 71' ' ' GLN . 1.1 mp0 -47.79 -51.5 22.27 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 124.441 1.097 . . . . 1.42 111.39 176.27 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.984 HD11 HD13 ' A' ' 68' ' ' LEU . 2.9 mp -77.59 -19.82 54.97 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.236 -1.347 . . . . 1.37 111.339 -166.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.9 t-80 54.54 50.0 17.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.817 0.818 . . . . 2.72 109.103 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.731 HG13 HG22 ' A' ' 69' ' ' THR . 30.9 mm -57.44 105.67 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 114.113 -1.403 . . . . 0.91 111.33 -177.055 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.757 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.91 -169.55 0.22 Allowed Pre-proline 0 C--N 1.315 -0.913 0 N-CA-C 107.022 -1.473 . . . . 0.51 107.022 -169.146 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.757 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 65.9 Cg_exo -28.92 165.38 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 124.674 3.583 . . . . 0.47 115.236 164.296 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.647 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -28.72 -32.67 0.01 OUTLIER Glycine 0 N--CA 1.469 0.834 0 N-CA-C 117.523 1.769 . . . . 0.4 117.523 -171.47 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.443 ' N ' ' O ' ' A' ' 76' ' ' PRO . 37.3 p -64.43 3.67 0.45 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 118.125 0.962 . . . . 0.56 112.618 -176.429 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.1 -14.36 62.96 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.235 0.54 . . . . 0.34 109.608 171.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.647 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 13.3 p90 -72.66 -20.81 61.18 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.791 -0.64 . . . . 4.13 109.44 175.115 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.479 ' O ' ' HG3' ' A' ' 85' ' ' GLN . 57.0 mt-30 -79.08 -30.05 43.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.442 0.639 . . . . 1.03 109.854 177.117 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -70.55 -49.17 50.82 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.9 -1.045 . . . . 0.48 109.263 173.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.491 ' O ' HG13 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -68.72 -16.69 63.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.053 -1.431 . . . . 1.18 110.773 176.264 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.578 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.5 tt0 -70.71 -52.43 21.0 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.086 -0.507 . . . . 0.8 110.809 178.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' A' ' 81' ' ' GLN . 58.4 mt-30 -45.64 -40.53 9.16 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 114.802 -1.09 . . . . 1.62 111.207 -179.018 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.918 ' HA ' ' HA2' ' B' 1005 ' ' GLY . 1.2 p -86.47 -47.71 16.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-N 113.55 -1.659 . . . . 1.3 111.697 -173.096 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.578 HG12 ' HA ' ' A' ' 84' ' ' GLU . 8.1 p -61.95 -24.95 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.882 0.849 . . . . 0.85 109.835 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.451 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 0.6 OUTLIER -62.11 -44.83 95.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.266 -1.334 . . . . 0.91 110.629 178.518 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.844 ' HB3' ' HB2' ' B' 1009 ' ' ALA . 7.9 mm-40 -71.66 -37.92 70.73 Favored 'General case' 0 CA--C 1.495 -1.164 0 CA-C-O 121.719 0.771 . . . . 2.87 109.758 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.514 HD23 ' HD2' ' A' ' 99' ' ' ARG . 16.3 mt -59.78 -19.03 47.95 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 113.781 -1.554 . . . . 1.28 111.884 -172.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.654 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 84.9 t80 -105.04 -35.58 7.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.51 0.672 . . . . 2.3 111.489 -177.054 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.451 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 8.4 ptm180 -84.0 -36.41 23.18 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.863 -0.608 . . . . 5.06 111.471 -172.122 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -95.85 21.21 8.83 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.901 -0.59 . . . . 3.12 112.58 -170.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.19 68.41 0.11 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 117.665 -2.207 . . . . 2.31 115.814 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.654 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 60.8 t -74.98 102.1 2.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 118.599 1.2 . . . . 1.06 111.243 174.319 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.419 ' H ' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -111.54 -173.18 2.19 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.547 -1.206 . . . . 2.12 108.402 173.072 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.573 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 7.5 m95 -61.98 -55.31 30.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.707 0.289 . . . . 3.34 111.245 177.092 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.68 -15.46 71.09 Favored Glycine 0 CA--C 1.519 0.314 0 C-N-CA 120.943 -0.646 . . . . 0.69 113.097 -178.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.592 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 20.3 tpp180 -69.82 -43.49 71.91 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.218 0.532 . . . . 4.24 110.622 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.481 ' O ' ' HD1' ' A' ' 104' ' ' PHE . 61.2 mt -68.09 -34.98 69.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.447 -0.797 . . . . 0.44 111.38 -175.036 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -60.74 -29.19 44.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 120.841 0.353 . . . . 1.35 110.774 179.062 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.436 ' O ' ' HD1' ' A' ' 106' ' ' PHE . . . -62.55 -46.93 86.1 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.447 0.641 . . . . 0.44 110.268 177.479 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.619 ' HA ' ' CE1' ' A' ' 106' ' ' PHE . 30.8 t80 -53.43 -37.71 62.82 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.356 -1.293 . . . . 1.49 111.211 177.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.671 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 47.7 m-85 -76.53 -39.47 52.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.298 -0.41 . . . . 3.29 111.116 178.139 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.689 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 22.6 t -63.04 -54.86 31.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.013 -0.54 . . . . 1.19 111.317 -176.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.619 ' CE1' ' HA ' ' A' ' 103' ' ' PHE . 3.9 p90 -76.81 -23.51 52.82 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.436 -0.506 . . . . 2.89 110.41 -177.404 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.38 -44.64 73.12 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 110.8 -0.92 . . . . 0.3 110.8 174.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.993 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.32 -31.18 79.64 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.874 -0.679 . . . . 0.23 111.53 175.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -76.0 -28.87 57.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.787 0.327 . . . . 0.31 110.745 176.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.46 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.66 -41.78 98.17 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.083 -1.08 . . . . 1.12 108.083 178.366 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.699 ' SG ' HG22 ' A' ' 123' ' ' VAL . 16.9 t -49.63 -51.66 36.14 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 113.449 -1.705 . . . . 0.26 110.964 172.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.538 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 69.1 t -65.66 -40.94 89.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.346 -0.388 . . . . 0.35 111.924 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.714 ' HB3' HG21 ' A' ' 74' ' ' ILE . 18.3 mm-40 -63.03 -22.85 67.14 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.238 0.542 . . . . 2.51 110.499 178.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.488 ' HB3' ' HB2' ' A' ' 122' ' ' LEU . 26.4 m -76.99 -37.76 54.5 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.977 -0.749 . . . . 0.28 108.977 174.318 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' ' 111' ' ' CYS . 98.1 t -66.17 -35.11 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.147 -0.933 . . . . 1.23 109.332 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.512 ' OD2' ' HD3' ' A' ' 117' ' ' LYS . 25.9 t70 -52.0 -51.22 58.76 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 113.48 -1.691 . . . . 0.6 111.597 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.512 ' HD3' ' OD2' ' A' ' 116' ' ' ASP . 12.7 mmtp -85.38 13.78 6.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.017 -0.538 . . . . 1.62 110.282 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 61.79 44.38 8.68 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.715 0.769 . . . . 1.88 110.53 -178.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.494 ' HB3' HD23 ' A' ' 122' ' ' LEU . 25.8 mtm -119.74 44.8 2.3 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 107.871 -1.159 . . . . 0.31 107.871 -179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.459 ' HB3' ' CG ' ' A' ' 27' ' ' PHE . 0.6 OUTLIER -60.4 -7.2 1.9 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.52 -1.218 . . . . 1.15 112.845 -175.913 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.508 HG23 HD22 ' A' ' 122' ' ' LEU . 27.4 m -67.29 -25.14 32.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.628 0.251 . . . . 0.46 111.205 172.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.523 HD13 ' HD3' ' A' ' 125' ' ' ARG . 3.5 mm? -70.93 -29.33 65.34 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 110.161 -0.311 . . . . 0.26 110.161 177.449 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.699 HG22 ' SG ' ' A' ' 111' ' ' CYS . 72.2 t -44.79 -53.57 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 123.841 0.713 . . . . 0.25 111.78 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.61 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 0.0 OUTLIER -70.68 -37.15 73.6 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 116.057 -0.52 . . . . 1.35 111.244 -179.565 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.523 ' HD3' HD13 ' A' ' 122' ' ' LEU . 60.8 mtp180 -62.36 -57.05 12.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 116.142 -0.481 . . . . 2.67 110.502 -179.568 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.581 HG22 ' SD ' ' A' ' 130' ' ' MET . 76.7 mt -52.53 -49.82 42.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.677 -0.692 . . . . 0.23 110.613 -178.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.593 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.96 -36.84 70.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.942 0.401 . . . . 0.29 111.193 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.75 -60.86 2.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.336 0.589 . . . . 0.28 110.397 176.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -60.17 -32.61 71.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.638 -1.165 . . . . 3.91 111.227 -176.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.584 ' SD ' HD11 ' A' ' 13' ' ' LEU . 89.2 mtp -63.51 -56.43 16.11 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.954 0.407 . . . . 1.08 110.765 177.25 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.441 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -61.17 -37.03 81.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.27 -0.423 . . . . 0.25 110.545 179.394 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.425 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 98.0 m -63.22 -45.12 93.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.454 -0.339 . . . . 0.4 111.232 177.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -56.45 -40.34 74.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.176 0.512 . . . . 3.13 109.877 177.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 1.001 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.2 tt -65.06 -49.67 69.17 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.313 -0.625 . . . . 0.95 109.313 175.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ASN . . . . . 0.425 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 4.7 m-80 -49.91 -49.12 50.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.792 -0.64 . . . . 0.46 111.905 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -81.97 -54.54 5.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.15 -0.477 . . . . 0.59 111.86 -176.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.76 -51.03 5.43 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.283 0.846 . . . . 1.45 113.283 -169.012 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 1.001 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -79.88 -44.18 20.91 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 114.054 1.131 . . . . 1.2 114.054 -165.006 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.622 ' HA ' HD12 ' A' ' 142' ' ' ILE . 37.0 tt0 -47.18 -51.73 39.65 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 112.69 0.626 . . . . 0.75 112.69 -174.338 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.579 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 51.1 Cg_exo -52.75 -50.66 13.29 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 121.962 1.774 . . . . 0.56 111.784 177.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 4.2 t-105 -58.44 -50.75 72.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.51 -0.768 . . . . 1.2 110.441 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.622 HD12 ' HA ' ' A' ' 139' ' ' GLU . 54.7 mt -46.43 -53.87 2.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.117 -0.492 . . . . 0.32 111.613 175.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.603 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 78.3 mm-40 -59.16 -34.15 71.76 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.689 -0.687 . . . . 0.57 111.723 -178.068 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 67.8 mm-40 -63.3 -25.76 68.46 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.573 0.701 . . . . 0.78 111.029 177.106 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -96.06 -16.67 21.46 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.182 -0.917 . . . . 0.93 109.625 -171.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 142.62 -40.05 1.3 Allowed Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.478 -0.783 . . . . 0.56 112.665 175.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' GLY . . . . . 0.542 ' H ' ' HH2' ' A' ' 97' ' ' TRP . . . 120.36 170.62 14.3 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.958 -0.639 . . . . 0.49 111.675 -178.261 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.696 ' HZ2' HD21 ' A' ' 134' ' ' LEU . 6.8 m0 -65.92 -35.09 79.65 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.923 0.342 . . . . 3.57 111.923 -175.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.542 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 8.8 m-20 -63.23 -31.08 72.14 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.697 0.284 . . . . 1.96 110.247 177.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.531 ' O ' HD13 ' A' ' 154' ' ' LEU . 72.3 m -70.11 -36.06 74.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.416 -0.356 . . . . 0.67 110.867 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.573 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 91.1 t80 -62.27 -33.45 74.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.787 -0.82 . . . . 3.0 108.787 178.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.542 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 90.8 t -63.88 -52.83 51.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 114.438 -1.255 . . . . 1.15 111.131 174.5 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.517 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 24.0 mm-40 -48.75 -46.99 41.97 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.125 -0.943 . . . . 1.67 111.643 176.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.531 HD13 ' O ' ' A' ' 150' ' ' THR . 8.2 mp -78.17 -60.81 2.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.998 0.74 . . . . 1.3 112.998 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -119.85 27.48 8.67 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.187 -0.46 . . . . 4.24 110.632 -167.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.682 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -57.62 165.44 6.44 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 115.619 -0.719 . . . . 1.1 114.336 -179.389 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.946 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 29.4 t-20 -44.77 111.29 0.3 Allowed 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 113.308 -1.446 . . . . 1.29 112.107 -177.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 1.093 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 0.8 OUTLIER -76.45 -16.95 59.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.043 -0.526 . . . . 2.99 111.481 -174.059 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.422 ' HB3' ' OD1' ' A' ' 157' ' ' ASN . . . -57.42 -34.02 68.5 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.284 0.564 . . . . 2.52 109.607 171.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' A' ' 163' ' ' SER . . . -99.3 -34.98 10.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.662 -0.699 . . . . 2.87 110.698 174.477 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 1.093 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -59.37 -48.49 81.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.105 -0.498 . . . . 3.2 111.689 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.431 ' HA ' ' CB ' ' A' ' 165' ' ' LYS . 38.9 mt-10 -70.2 -15.09 62.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.632 0.253 . . . . 3.72 111.064 -178.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.455 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 32.8 t -68.68 -40.01 80.31 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.937 -0.764 . . . . 4.18 108.937 173.46 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 164' ' ' ARG . . . . . 0.614 ' HA ' ' HG2' ' A' ' 167' ' ' GLN . 1.8 mpp_? -78.51 -26.53 45.91 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.96 -0.564 . . . . 5.82 110.653 175.662 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.431 ' CB ' ' HA ' ' A' ' 162' ' ' GLU . 40.3 ttmt -56.99 -39.15 74.12 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.829 -0.623 . . . . 4.77 110.644 177.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -84.93 -39.98 8.34 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.89 -0.671 . . . . 5.1 113.261 -177.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.614 ' HG2' ' HA ' ' A' ' 164' ' ' ARG . 14.7 pt20 -77.22 -41.55 40.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 117.099 0.449 . . . . 5.72 111.591 -176.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.404 ' N ' ' HG3' ' A' ' 167' ' ' GLN . 24.6 mm-40 -81.07 13.29 2.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.91 0.386 . . . . 5.88 110.245 -178.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.455 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 4.3 tmt_? -58.02 -32.59 68.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.808 -0.633 . . . . 7.34 109.853 178.08 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.427 HD22 ' N ' ' A' ' 170' ' ' LEU . 3.2 mm? -72.83 -25.22 61.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.466 -0.788 . . . . 6.97 111.171 -178.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -100.92 -30.47 11.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.123 -0.49 . . . . 6.97 111.26 -176.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 57.6 m80 64.38 -169.35 0.2 Allowed 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.809 -0.632 . . . . 9.35 109.781 -173.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 38.5 m80 61.29 32.9 19.22 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.723 0.297 . . . . 11.4 110.661 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 45.8 p-80 -78.47 14.48 1.24 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.79 0.328 . . . . 11.52 111.709 -173.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -77.25 -11.49 59.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.914 -0.773 . . . . 14.48 108.914 166.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -121.27 163.13 19.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.859 -1.064 . . . . 15.37 108.343 173.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -118.27 135.01 54.54 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.125 0.488 . . . . 16.02 110.983 -178.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.666 ' H ' HD23 ' A' ' 178' ' ' LEU . 1.7 pt? -52.31 143.03 15.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.863 -1.062 . . . . 17.99 112.687 -176.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -99.97 -55.02 2.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.429 -0.805 . . . . 19.19 110.317 176.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 5.0 m-70 62.49 96.62 0.04 OUTLIER 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.304 -0.862 . . . . 22.26 109.856 -170.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -79.61 66.26 5.02 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.747 -0.66 . . . . 22.51 110.641 -174.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 18.0 t60 -107.22 -37.07 6.37 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.238 -1.023 . . . . 24.89 108.238 173.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -77.34 102.61 6.85 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.143 -0.935 . . . . 25.58 109.178 171.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 21.5 p-80 -109.85 148.86 30.75 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.804 -0.635 . . . . 27.37 110.15 -176.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 . . . . . 0 C--O 1.246 0.907 0 CA-C-O 118.398 -0.81 . . . . 29.06 109.828 -179.885 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.141 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -178.63 105.32 0.2 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.729 -0.748 . . . . 2.97 112.345 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.771 ' HB3' ' O62' ' B' 1100 ' ' 33B . 6.8 m -123.91 -146.13 0.35 Allowed 'General case' 0 C--N 1.322 -0.62 0 O-C-N 122.683 -0.304 . . . . 1.94 110.316 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.804 HG23 ' H ' ' B' 1005 ' ' GLY . 9.4 m 50.47 -79.2 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.348 0 C-N-CA 125.085 1.354 . . . . 1.63 113.224 178.013 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 1005 ' ' GLY . . . . . 0.918 ' HA2' ' HA ' ' A' ' 86' ' ' VAL . . . -47.1 -60.84 4.81 Favored Glycine 0 N--CA 1.43 -1.702 0 C-N-CA 119.911 -1.138 . . . . 1.2 110.594 171.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 1006 ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' B' 1006 ' ' ARG . 29.4 mmt180 -56.63 -40.31 75.18 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 111.989 0.366 . . . . 2.88 111.989 176.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -66.98 -52.39 43.35 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 120.692 0.282 . . . . 1.31 111.456 -175.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.819 ' HB2' HG23 ' A' ' 86' ' ' VAL . 3.8 mm? -75.14 -37.41 61.39 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.842 0.353 . . . . 1.33 110.872 -174.08 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 1009 ' ' ALA . . . . . 0.844 ' HB2' ' HB3' ' A' ' 89' ' ' GLU . . . -45.72 -47.54 15.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.743 0.782 . . . . 0.88 110.057 165.495 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.891 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -75.56 -60.4 2.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.726 -1.124 . . . . 1.03 112.121 -177.072 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.631 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 50.2 m-85 -59.0 -33.25 70.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.945 -0.571 . . . . 1.67 111.829 -176.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -67.2 -20.79 71.5 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.886 -0.673 . . . . 0.78 113.417 -175.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 28.3 t70 -67.56 -20.16 65.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.868 0.334 . . . . 1.9 111.213 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 10.6 m -81.04 0.02 37.71 Favored 'General case' 0 C--O 1.227 -0.106 0 CA-C-O 120.901 0.381 . . . . 1.44 110.952 -175.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.483 HD11 ' CD1' ' A' ' 57' ' ' PHE . 2.9 mt -99.45 11.07 6.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.698 0.761 . . . . 2.91 109.811 177.175 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -146.42 -48.15 0.2 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.668 -0.696 . . . . 4.29 110.187 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 86.7 mtm180 -116.24 -82.45 0.62 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.078 -0.51 . . . . 8.17 109.955 177.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.532 -0.304 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.891 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.2 tpp . . . . . 0 N--CA 1.477 0.88 0 CA-C-O 120.535 0.207 . . . . 6.21 111.103 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.6 p -132.49 -32.3 1.33 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.778 0.288 . . . . 1.87 111.778 -177.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 -86.38 1.84 49.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.643 0.735 . . . . 2.42 110.008 -178.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.685 ' HA ' ' HB2' ' A' ' 37' ' ' ALA . 20.0 m -69.77 -15.42 63.13 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.02 -0.991 . . . . 1.25 112.351 -176.381 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.592 ' HB3' HD22 ' A' ' 134' ' ' LEU . 1.1 p30 -61.19 -18.7 59.57 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.092 -0.504 . . . . 1.78 110.848 175.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.558 ' O ' HG23 ' A' ' 10' ' ' VAL . 20.0 tpp85 -60.25 -45.5 93.04 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.861 -0.609 . . . . 1.4 109.844 175.021 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.488 ' HG3' ' HB3' ' A' ' 37' ' ' ALA . 42.6 mt-10 -59.56 -52.86 63.72 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.827 -0.624 . . . . 0.68 111.274 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.57 HD22 ' HA ' ' A' ' 5' ' ' ASN . 2.7 mp -45.66 -37.46 5.76 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.223 -0.899 . . . . 1.16 111.47 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 70.0 t -76.81 -62.52 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.055 -0.521 . . . . 0.27 110.659 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 6' ' ' ARG . 86.5 t -52.14 -49.96 37.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.373 -0.831 . . . . 0.33 112.841 -174.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -54.07 -32.64 55.28 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.508 0.505 . . . . 0.59 110.653 -175.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.558 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 55.7 t80 -84.12 -44.64 13.82 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.285 -0.416 . . . . 1.61 111.548 -179.128 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.889 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.7 mp -58.13 -40.5 81.42 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 120.024 -0.67 . . . . 0.34 109.98 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.413 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 23.1 t -60.73 -40.89 94.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.99 -0.55 . . . . 1.05 110.312 176.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -73.51 -25.39 60.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.814 -0.63 . . . . 1.22 111.309 -178.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.716 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.6 OUTLIER -78.52 -50.24 11.95 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-O 121.226 0.536 . . . . 1.41 110.094 -174.637 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.701 HD21 ' SG ' ' A' ' 111' ' ' CYS . 13.2 mt -55.18 -29.78 58.56 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.511 -0.768 . . . . 1.35 111.277 173.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.7 t -60.81 -29.02 69.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.47 -0.787 . . . . 0.94 111.908 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.716 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 20.8 pt20 -75.29 -16.72 60.41 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.201 0.524 . . . . 1.37 110.932 -176.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.798 ' HD2' HG22 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -100.66 -23.69 14.59 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 122.197 0.999 . . . . 2.2 108.58 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.01 26.28 7.55 Favored Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 113.651 -1.613 . . . . 0.53 112.468 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.489 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 86.8 m-85 -112.61 166.61 11.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.542 0.21 . . . . 0.76 110.801 176.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.1 t -109.31 151.29 26.79 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.263 -0.426 . . . . 0.52 110.632 -178.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.671 ' CH2' ' HB2' ' A' ' 31' ' ' GLU . 3.0 t90 -75.06 -52.9 9.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.073 -0.512 . . . . 3.36 110.356 175.257 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.433 ' HB2' ' CE3' ' A' ' 24' ' ' TRP . 22.6 t -72.45 -18.55 61.68 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.227 -0.442 . . . . 1.37 111.495 -172.162 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -65.53 -22.48 66.72 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.191 -0.604 . . . . 1.11 110.785 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -108.96 -33.75 6.83 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.826 -0.625 . . . . 1.28 110.863 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.701 ' HB3' HG22 ' A' ' 30' ' ' VAL . 10.6 m -101.54 143.84 31.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.71 0.767 . . . . 1.81 112.112 -177.233 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.502 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 15.4 t70 -108.15 -7.4 16.05 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.162 -1.381 . . . . 2.31 109.383 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.843 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.0 m -53.61 -72.97 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 114.067 -1.424 . . . . 0.92 112.915 -170.116 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.843 ' H ' HG23 ' A' ' 30' ' ' VAL . 20.5 mm-40 -91.57 1.5 57.1 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.965 -0.754 . . . . 2.74 108.965 178.251 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.502 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.1 tt0 -64.74 -44.11 91.17 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 114.834 -1.075 . . . . 1.45 110.205 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -108.07 -66.1 1.07 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.608 -0.724 . . . . 1.87 110.728 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.462 ' HG2' ' O ' ' A' ' 30' ' ' VAL . 11.3 ptp180 -79.53 167.56 20.59 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.342 -0.614 . . . . 3.39 109.342 176.611 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 21.6 p -135.05 113.98 11.99 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.036 0.446 . . . . 2.25 110.361 176.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -71.81 -62.41 1.43 Allowed 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.668 -0.697 . . . . 3.34 110.22 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.685 ' HB2' ' HA ' ' A' ' 4' ' ' SER . . . -99.5 163.87 17.72 Favored Pre-proline 0 C--N 1.314 -0.939 0 CA-C-N 115.294 -0.866 . . . . 1.92 110.514 176.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.479 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 50.1 Cg_exo -58.64 -170.69 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.211 2.607 . . . . 1.87 112.63 171.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -79.67 10.49 3.95 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.222 0.534 . . . . 4.64 110.4 176.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.716 ' HA2' ' OG ' ' A' ' 43' ' ' SER . . . 128.94 71.15 0.14 Allowed Glycine 0 N--CA 1.438 -1.202 0 CA-C-N 115.652 -0.703 . . . . 2.15 111.403 -176.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.698 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.3 t -74.11 -71.94 0.3 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 120.387 -0.525 . . . . 1.12 110.145 -177.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.698 ' H ' HG23 ' A' ' 41' ' ' THR . 0.0 OUTLIER -92.18 -34.98 14.09 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.551 0.691 . . . . 2.02 109.393 169.095 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.772 ' HA ' HG13 ' A' ' 46' ' ' VAL . 7.3 p -47.95 -39.29 18.89 Favored 'General case' 0 C--O 1.214 -0.794 0 CA-C-N 113.943 -1.481 . . . . 1.25 112.846 -171.343 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -39.4 -51.17 2.11 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 123.946 0.779 . . . . 1.91 111.989 -175.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.418 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -75.72 -42.61 50.29 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 121.186 -0.206 . . . . 0.52 111.414 179.222 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.772 HG13 ' HA ' ' A' ' 43' ' ' SER . 0.5 OUTLIER -68.0 -44.87 84.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 N-CA-C 111.652 0.241 . . . . 1.41 111.652 -175.902 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.769 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.0 ptpt -67.35 -39.3 85.73 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.293 -0.632 . . . . 0.67 109.293 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.491 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 27.1 mm-40 -57.83 -43.83 86.07 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 115.631 -0.713 . . . . 0.99 111.635 174.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.588 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -70.46 -34.95 73.0 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.243 0.544 . . . . 0.42 110.42 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.451 ' HG ' ' CE1' ' A' ' 104' ' ' PHE . 4.0 tp -64.84 -28.48 69.58 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.322 -0.854 . . . . 1.33 111.695 -175.449 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.427 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 3.8 ptp85 -86.88 -23.04 25.37 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.271 0.558 . . . . 2.17 110.108 -177.296 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.569 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.3 mm-40 -70.63 -47.42 60.14 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.091 -0.959 . . . . 1.1 109.826 175.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.03 -36.47 75.09 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.736 -0.665 . . . . 0.53 109.438 171.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.63 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -57.9 -44.54 94.37 Favored Glycine 0 C--O 1.219 -0.79 0 CA-C-N 114.995 -1.002 . . . . 0.7 112.276 178.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -52.36 -44.59 65.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.906 0.384 . . . . 1.04 111.329 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 41.6 mt-10 -67.47 -29.05 68.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.791 -0.641 . . . . 2.29 111.721 179.344 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.5 ' HE1' ' HA2' ' B' 1012 ' ' GLY . 13.4 m-85 -81.03 -41.96 21.85 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.973 -0.558 . . . . 2.29 111.255 176.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.63 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.0 mt-10 -55.85 -50.02 71.73 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.189 0.519 . . . . 1.3 109.869 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.463 HD12 ' N ' ' A' ' 60' ' ' ARG . 3.8 pp -64.6 -35.05 79.73 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.232 -0.894 . . . . 1.54 110.648 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.463 ' N ' HD12 ' A' ' 59' ' ' LEU . 8.6 ttt180 -70.1 -44.96 67.96 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 120.377 -0.529 . . . . 2.58 111.203 -167.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -90.54 -3.75 57.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.294 -0.412 . . . . 5.32 111.196 -179.41 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.529 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 51.2 ttp180 -50.06 -37.23 32.46 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.174 0.805 . . . . 4.48 113.174 -171.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 -66.97 -38.79 86.74 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.985 0.422 . . . . 4.72 110.937 -179.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.666 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.76 -42.82 9.36 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.603 0.964 . . . . 1.17 113.603 -172.413 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.529 ' CD1' ' HA ' ' A' ' 62' ' ' ARG . 8.1 p90 -52.69 -39.13 61.68 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.045 1.128 . . . . 2.81 114.045 -161.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.9 t -85.49 -21.74 28.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.155 0.502 . . . . 2.19 110.066 -175.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -77.46 -31.84 54.07 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.038 -0.727 . . . . 2.72 109.038 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.666 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 61.8 mt -63.46 -15.09 56.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.975 -1.011 . . . . 1.56 112.032 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.777 HG22 HG13 ' A' ' 74' ' ' ILE . 17.5 p -54.36 -37.06 64.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.254 0.55 . . . . 0.7 110.474 -177.158 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 67.2 m -61.71 -31.51 71.66 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.063 -0.971 . . . . 1.34 111.123 176.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.429 ' OE1' HD22 ' A' ' 68' ' ' LEU . 43.2 mt-30 -80.69 -47.69 13.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.603 -0.726 . . . . 1.42 110.224 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.586 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mp -68.1 -31.81 71.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.544 -0.753 . . . . 1.37 110.444 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.442 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 50.4 m-70 68.51 64.06 0.34 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.607 0.718 . . . . 2.72 109.91 -173.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.777 HG13 HG22 ' A' ' 69' ' ' THR . 26.0 mm -65.02 108.88 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.477 -1.238 . . . . 0.91 110.594 178.181 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.738 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.83 -171.49 0.27 Allowed Pre-proline 0 C--N 1.316 -0.869 0 N-CA-C 107.45 -1.315 . . . . 0.51 107.45 -169.396 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.738 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.0 Cg_exo -30.91 166.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 124.777 3.652 . . . . 0.47 114.766 164.243 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.489 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.33 -28.87 0.01 OUTLIER Glycine 0 N--CA 1.476 1.353 0 N-CA-C 117.225 1.65 . . . . 0.4 117.225 -173.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.46 ' N ' ' O ' ' A' ' 76' ' ' PRO . 31.2 p -68.87 3.46 1.96 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.838 0.819 . . . . 0.56 112.0 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.02 -14.51 61.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.184 0.516 . . . . 0.34 109.675 170.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.452 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 44.0 t80 -75.54 -22.79 56.75 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.761 -0.654 . . . . 4.13 109.372 174.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.445 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 34.0 mt-30 -82.57 -23.9 34.23 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.625 0.726 . . . . 1.03 109.865 174.093 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 13.7 m -72.68 -53.76 10.86 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 114.557 -1.201 . . . . 0.48 109.565 171.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.436 ' HA ' HG23 ' A' ' 86' ' ' VAL . 85.3 t80 -65.79 -17.92 64.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.029 -0.987 . . . . 1.18 110.229 175.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.604 ' HA ' HG12 ' A' ' 87' ' ' VAL . 34.7 tt0 -60.9 -49.34 77.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.884 -0.598 . . . . 0.8 110.389 177.201 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -50.6 -34.31 25.42 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.988 -1.006 . . . . 1.62 110.622 176.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.596 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 1.8 t -80.63 -51.54 15.64 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 114.646 -1.161 . . . . 1.3 110.602 -176.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.604 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.0 p -63.54 -21.75 29.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.826 0.822 . . . . 0.85 109.841 -179.055 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.2 m-80 -78.53 -45.49 21.76 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.367 -1.288 . . . . 0.91 111.615 175.28 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 1.028 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 16.2 pt-20 -69.57 -32.3 70.98 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 107.961 -1.125 . . . . 2.87 107.961 -178.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.596 ' HB2' ' O ' ' A' ' 86' ' ' VAL . 0.2 OUTLIER -60.61 -31.06 70.25 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 113.182 -1.827 . . . . 1.28 111.152 177.983 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.677 ' HA ' HG22 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -99.27 -38.29 8.93 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.07 0.462 . . . . 2.3 111.29 -169.533 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.56 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 10.3 ptm180 -72.65 -34.22 67.11 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.652 -0.704 . . . . 5.06 110.586 -174.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -89.13 8.63 29.02 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.851 -1.068 . . . . 3.12 112.31 -172.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.68 72.52 0.11 Allowed Glycine 0 C--N 1.337 0.618 0 C-N-CA 117.01 -2.519 . . . . 2.31 116.15 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.874 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 48.8 t -71.1 92.62 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 CA-C-N 119.053 1.427 . . . . 1.06 111.361 177.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -114.65 -170.81 1.81 Allowed 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.493 -1.23 . . . . 2.12 108.854 178.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.843 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 13.4 m-90 -58.84 -38.0 77.72 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.064 0.459 . . . . 3.34 110.865 177.484 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.967 ' HA3' HG21 ' B' 1015 ' ' ILE . . . -83.47 -32.19 25.66 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.91 -0.662 . . . . 0.69 114.536 -170.15 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.874 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 0.6 OUTLIER -69.1 -30.08 68.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 118.078 0.939 . . . . 4.24 109.587 -176.935 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 82.2 mt -69.81 -34.19 59.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.4 0.619 . . . . 0.44 109.53 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.553 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 79.5 t -55.03 -58.66 3.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 114.935 -1.029 . . . . 1.35 110.045 168.091 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -51.39 -41.74 60.92 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.773 -0.649 . . . . 0.44 110.873 176.369 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -59.78 -54.3 47.9 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.441 -0.799 . . . . 1.49 112.02 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.496 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.4 OUTLIER -72.76 -23.53 60.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.035 0.445 . . . . 3.29 110.435 -176.44 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.558 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 13.3 t -76.32 -53.88 7.57 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.794 -0.639 . . . . 1.19 110.521 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -66.9 -28.07 68.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.009 0.433 . . . . 2.89 109.911 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.487 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -65.72 -44.09 93.0 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.79 -0.641 . . . . 0.3 111.71 174.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.889 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.79 -35.27 91.8 Favored Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.461 -0.876 . . . . 0.23 111.222 175.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.73 -28.91 65.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.556 -0.322 . . . . 0.31 110.81 177.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.417 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.24 -39.62 95.12 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.171 -1.048 . . . . 1.12 108.171 179.407 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.701 ' SG ' HD21 ' A' ' 17' ' ' LEU . 42.1 t -55.24 -53.04 61.12 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 113.989 -1.46 . . . . 0.26 110.735 174.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.798 HG22 ' HD2' ' A' ' 20' ' ' LYS . 65.9 t -63.14 -39.6 85.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.403 -0.362 . . . . 0.35 111.852 -177.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.463 ' HB3' HG21 ' A' ' 74' ' ' ILE . 2.5 mm-40 -65.57 -22.89 66.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.058 0.456 . . . . 2.51 110.917 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.412 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 49.1 m -79.28 -41.34 28.32 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.903 -0.777 . . . . 0.28 108.903 175.574 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.594 HG21 ' CD2' ' A' ' 17' ' ' LEU . 98.0 t -65.42 -32.94 60.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 114.999 -1.0 . . . . 1.23 109.293 179.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.36 -50.55 59.3 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 113.313 -1.767 . . . . 0.6 111.411 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.423 ' HB2' ' HG3' ' A' ' 119' ' ' MET . 10.9 mmtp -87.03 11.07 14.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.829 -0.623 . . . . 1.62 110.441 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 66.03 43.56 2.92 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-O 121.662 0.744 . . . . 1.88 110.227 -178.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.423 ' HG3' ' HB2' ' A' ' 117' ' ' LYS . 26.6 mtm -118.22 48.42 1.42 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.073 -1.084 . . . . 0.31 108.073 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.415 ' HG2' HG13 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -63.73 -7.27 7.18 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.641 -1.163 . . . . 1.15 112.529 -175.092 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.516 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 34.2 m -65.19 -27.2 41.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 120.708 0.29 . . . . 0.46 110.918 174.189 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.706 HD13 ' HD2' ' A' ' 125' ' ' ARG . 2.9 mm? -72.48 -27.33 62.22 Favored 'General case' 0 CA--C 1.51 -0.562 0 CA-C-N 116.589 -0.278 . . . . 0.26 110.684 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.68 HG22 ' SG ' ' A' ' 111' ' ' CYS . 70.3 t -44.22 -53.44 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 O-C-N 123.8 0.687 . . . . 0.25 111.938 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.2 -35.69 66.4 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.756 -0.656 . . . . 1.35 111.393 -178.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.706 ' HD2' HD13 ' A' ' 122' ' ' LEU . 70.8 mtt180 -64.78 -52.53 56.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.827 -0.624 . . . . 2.67 110.344 -178.399 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.592 HG22 ' SD ' ' A' ' 130' ' ' MET . 73.1 mt -54.11 -51.89 42.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.605 -0.725 . . . . 0.23 110.785 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.674 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -57.46 -36.34 71.3 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.713 0.292 . . . . 0.29 111.417 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.27 -58.8 6.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.288 0.566 . . . . 0.28 110.67 177.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -64.24 -33.71 76.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.021 -0.99 . . . . 3.91 111.49 -176.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.592 ' SD ' HG22 ' A' ' 126' ' ' ILE . 88.8 mtp -61.96 -54.59 39.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.04 0.448 . . . . 1.08 110.75 178.333 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.89 94.8 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.798 -0.637 . . . . 0.25 111.086 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 92.0 m -62.75 -43.9 97.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.875 0.369 . . . . 0.4 110.776 178.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.573 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 71.8 t80 -56.34 -42.85 78.39 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.226 -0.443 . . . . 3.13 110.032 176.285 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.933 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 4.9 tt -63.36 -48.01 79.72 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.102 -0.703 . . . . 0.95 109.102 175.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -49.83 -55.67 13.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.895 -0.593 . . . . 0.46 112.59 178.12 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -83.49 -47.2 11.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.064 0.459 . . . . 0.59 111.82 -173.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' HIS . . . . . 0.573 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 44.3 m-70 -90.92 -51.36 5.39 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 112.756 0.65 . . . . 1.45 112.756 -170.178 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.933 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -83.23 -46.59 12.49 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 114.515 1.302 . . . . 1.2 114.515 -165.072 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.603 ' HA ' HD12 ' A' ' 142' ' ' ILE . 28.3 tt0 -44.98 -52.42 19.4 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.432 0.53 . . . . 0.75 112.432 -173.301 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.619 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.3 Cg_exo -53.38 -53.52 6.49 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.654 1.57 . . . . 0.56 111.715 176.677 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -55.0 -51.11 67.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.583 -0.735 . . . . 1.2 110.347 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.603 HD12 ' HA ' ' A' ' 139' ' ' GLU . 73.6 mt -46.83 -53.89 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.823 -0.626 . . . . 0.32 111.805 174.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.601 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 77.3 mm-40 -61.95 -29.87 70.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.896 -0.593 . . . . 0.57 111.725 -178.656 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.619 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.6 mm-40 -64.81 -20.77 66.57 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.78 0.8 . . . . 0.78 109.898 175.532 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ASN . . . . . 0.463 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 2.2 m-20 -104.23 2.26 31.46 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.89 -1.05 . . . . 0.93 108.783 -176.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 127.1 -54.39 0.77 Allowed Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 114.668 -1.151 . . . . 0.56 112.011 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' GLY . . . . . 0.453 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 137.41 -177.75 19.59 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.922 -0.656 . . . . 0.49 111.784 -177.439 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.442 ' HE1' HD13 ' A' ' 142' ' ' ILE . 11.8 m0 -68.02 -45.63 73.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.179 0.514 . . . . 3.57 110.084 -179.099 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -63.72 -34.57 78.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.458 -0.792 . . . . 1.96 111.123 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.579 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 66.0 m -66.77 -30.66 70.92 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.493 -0.322 . . . . 0.67 111.702 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.843 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 86.8 t80 -59.14 -38.54 79.95 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.339 -0.544 . . . . 3.0 109.84 174.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -75.83 -25.73 17.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.261 -0.427 . . . . 1.15 110.19 177.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.575 ' CG ' ' HA ' ' A' ' 150' ' ' THR . 55.1 mt-10 -55.52 -31.0 61.71 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-O 121.216 0.531 . . . . 1.67 109.835 172.108 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 150' ' ' THR . 0.6 OUTLIER -101.92 -50.67 3.61 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.397 -0.819 . . . . 1.3 110.984 -176.664 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 155' ' ' TYR . . . . . 0.46 ' CD2' ' HB2' ' A' ' 154' ' ' LEU . 97.9 m-85 -120.69 26.08 9.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.789 -0.641 . . . . 4.24 111.653 -170.073 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.588 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -60.22 164.12 15.21 Favored Glycine 0 C--N 1.317 -0.506 0 CA-C-O 121.733 0.629 . . . . 1.1 113.685 -176.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.569 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 29.3 t-20 -53.25 128.06 26.74 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 113.835 -1.182 . . . . 1.29 112.212 -176.258 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.579 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 62.0 t30 -66.46 -31.13 71.67 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.924 -0.58 . . . . 2.99 111.859 -173.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.463 ' HB3' ' OD1' ' A' ' 157' ' ' ASN . . . -59.59 -30.19 68.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.214 0.531 . . . . 2.52 110.463 176.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -85.44 -40.07 16.82 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.03 -0.532 . . . . 2.87 110.029 174.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.579 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -58.61 -47.82 83.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.827 -0.624 . . . . 3.2 111.126 178.236 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.498 ' HA ' ' HB3' ' A' ' 165' ' ' LYS . 28.3 mt-10 -69.08 -24.42 64.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.875 -0.602 . . . . 3.72 111.227 179.208 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 33.2 t -68.0 -34.74 77.09 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.362 -0.607 . . . . 4.18 109.362 175.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 27.0 mmm180 -85.48 -6.23 59.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.377 -0.829 . . . . 5.82 110.32 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.498 ' HB3' ' HA ' ' A' ' 162' ' ' GLU . 35.2 ttpt -99.03 -60.83 1.46 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.264 -0.88 . . . . 4.77 110.511 -178.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -69.72 -9.39 62.2 Favored Glycine 0 N--CA 1.444 -0.828 0 CA-C-N 114.867 -1.06 . . . . 5.1 113.403 -173.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -55.54 -17.09 4.72 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.88 0.371 . . . . 5.72 111.973 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.87 ' HG3' ' HA ' ' A' ' 172' ' ' HIS . 33.8 tt0 -68.53 -6.12 23.48 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.358 0.599 . . . . 5.88 110.874 176.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.537 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 0.3 OUTLIER -59.75 -32.87 70.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.831 -0.622 . . . . 7.34 110.362 174.831 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -75.05 -44.12 49.48 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.937 0.399 . . . . 6.97 110.201 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -169.61 159.91 8.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.549 -0.75 . . . . 6.97 109.196 177.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 172' ' ' HIS . . . . . 0.87 ' HA ' ' HG3' ' A' ' 168' ' ' GLU . 36.6 m80 -69.98 152.26 44.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.732 -0.213 . . . . 9.35 110.622 -176.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -64.02 103.18 0.57 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.335 0.588 . . . . 11.4 109.648 176.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 38.5 m80 60.14 -166.52 0.19 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.422 -0.808 . . . . 11.52 110.042 -171.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 31.3 m170 66.1 21.82 11.16 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.148 0.499 . . . . 14.48 110.713 178.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -72.52 -33.66 67.04 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.104 -0.702 . . . . 15.37 109.104 177.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 66.1 m-70 -109.71 131.7 54.82 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.612 -0.722 . . . . 16.02 110.482 178.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.538 HD23 ' H ' ' A' ' 178' ' ' LEU . 1.8 pt? -117.17 16.9 14.9 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.369 -0.604 . . . . 17.99 109.369 174.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -65.8 100.01 0.51 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.109 -0.951 . . . . 19.19 110.681 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -109.2 -34.75 6.48 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.792 -0.64 . . . . 22.26 110.019 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -76.13 150.57 37.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.074 -0.512 . . . . 22.51 110.39 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -95.1 109.8 21.81 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.365 -0.605 . . . . 24.89 109.365 172.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 80.5 t60 -70.52 112.77 7.04 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.772 -0.649 . . . . 25.58 110.415 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -103.29 79.3 1.7 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.082 -0.508 . . . . 27.37 110.22 -177.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 52.8 t60 . . . . . 0 C--O 1.244 0.792 0 CA-C-N 115.8 -0.636 . . . . 29.06 109.48 179.7 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.239 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -74.1 -34.23 55.73 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.881 -0.676 . . . . 2.97 112.366 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.552 ' O ' HG22 ' B' 1004 ' ' VAL . 57.3 m -136.51 -161.7 1.19 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.688 0.28 . . . . 1.94 110.264 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.615 ' O ' ' HD3' ' B' 1006 ' ' ARG . 1.0 OUTLIER 59.93 162.31 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 125.367 1.467 . . . . 1.63 111.434 176.584 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B 1005 ' ' GLY . . . . . 0.875 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . 56.87 3.93 0.85 Allowed Glycine 0 CA--C 1.539 1.577 0 C-N-CA 120.218 -0.992 . . . . 1.2 111.902 -155.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 1006 ' ' ARG . . . . . 0.615 ' HD3' ' O ' ' B' 1004 ' ' VAL . 6.4 mpt_? -133.14 -61.27 0.83 Allowed 'General case' 0 C--O 1.227 -0.111 0 C-N-CA 124.325 1.05 . . . . 2.88 110.387 -177.003 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 1007 ' ' ALA . . . . . 0.606 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -70.32 -49.44 49.4 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.14 -0.936 . . . . 1.31 112.593 -169.408 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.583 ' HB2' ' CD ' ' A' ' 89' ' ' GLU . 2.8 mm? -66.53 -39.82 88.8 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.084 -0.71 . . . . 1.33 109.084 -176.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 1009 ' ' ALA . . . . . 1.028 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -52.19 -57.46 9.59 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.51 -1.223 . . . . 0.88 110.44 171.313 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.834 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -69.22 -38.05 78.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 113.905 -1.498 . . . . 1.03 112.276 -172.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.641 ' CE1' ' H14' ' B' 1100 ' ' 33B . 3.9 m-30 -74.77 -24.57 58.71 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.236 -0.438 . . . . 1.67 111.084 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 1012 ' ' GLY . . . . . 0.5 ' HA2' ' HE1' ' A' ' 57' ' ' PHE . . . -76.95 -9.84 86.5 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 121.151 -0.547 . . . . 0.78 112.937 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.08 -23.66 66.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.962 0.411 . . . . 1.9 111.241 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1014 ' ' CYS . . . . . 0.421 ' N ' ' C20' ' B' 1100 ' ' 33B . 69.8 m -93.62 94.6 8.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.838 0.351 . . . . 1.44 110.961 -175.146 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.967 HG21 ' HA3' ' A' ' 98' ' ' GLY . 22.4 pt -107.49 9.95 9.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.175 -0.466 . . . . 2.91 110.987 178.286 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 17.7 m120 -114.0 -54.59 2.58 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.847 -0.615 . . . . 4.29 109.385 174.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 24.6 ptt180 -127.19 86.1 2.45 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.333 0.587 . . . . 8.17 110.278 177.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.53 0 CA-C-N 116.187 -0.46 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.834 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.514 ' HB2' ' OE2' ' A' ' 139' ' ' GLU . 61.8 mtm . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 120.963 0.411 . . . . 6.21 110.084 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.452 ' H ' ' CD ' ' A' ' 139' ' ' GLU . 8.5 m -96.66 129.08 44.12 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.102 -0.703 . . . . 1.87 109.102 175.151 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -86.9 2.27 49.77 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.366 -0.533 . . . . 2.42 111.77 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.518 ' HB3' ' OE2' ' A' ' 42' ' ' GLU . 4.8 m -67.6 -30.41 69.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.399 -0.364 . . . . 1.25 110.732 176.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.483 ' ND2' HD22 ' A' ' 134' ' ' LEU . 0.0 OUTLIER -62.3 -15.31 47.05 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.158 0.504 . . . . 1.78 110.109 -178.436 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.704 HH12 ' HA ' ' A' ' 128' ' ' ALA . 24.6 tpp180 -52.99 -49.94 65.16 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.368 -0.833 . . . . 1.4 110.743 174.801 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.611 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 42.8 mt-10 -52.6 -52.01 57.22 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.366 -1.288 . . . . 0.68 111.873 -174.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.58 HD21 HG11 ' A' ' 46' ' ' VAL . 0.4 OUTLIER -46.42 -45.96 18.34 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.163 -0.926 . . . . 1.16 110.788 177.656 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.665 HG13 ' HE2' ' A' ' 130' ' ' MET . 70.9 t -68.59 -61.36 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-O 121.253 0.549 . . . . 0.27 110.187 178.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 6' ' ' ARG . 63.3 t -51.65 -52.47 21.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 114.917 -1.038 . . . . 0.33 112.66 -173.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -58.98 -35.31 72.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.065 -0.516 . . . . 0.59 111.105 -176.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.699 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 26.9 t80 -77.35 -38.67 49.79 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 120.561 -0.456 . . . . 1.61 111.178 -176.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.811 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.3 mp -59.4 -38.78 81.46 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 119.825 -0.75 . . . . 0.34 109.499 175.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.453 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 40.6 t -60.8 -45.67 93.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.369 0.604 . . . . 1.05 110.581 175.238 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -62.08 -32.56 73.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.275 -0.875 . . . . 1.22 111.037 -178.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.609 ' HA ' ' CE ' ' A' ' 16' ' ' LYS . 4.4 mmpt? -72.46 -43.94 63.02 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 113.102 0.778 . . . . 1.41 113.102 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.658 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -64.39 -24.17 67.54 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.76 -0.376 . . . . 1.35 111.159 -178.376 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.0 t -58.09 -45.12 87.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.47 . . . . 0.94 111.554 -178.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -76.87 0.26 21.51 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.05 0.452 . . . . 1.37 111.834 -177.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.0 mmmt -109.98 -28.19 8.85 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.816 0.817 . . . . 2.2 109.313 -178.36 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.82 23.26 9.43 Favored Glycine 0 N--CA 1.442 -0.905 0 CA-C-N 114.087 -1.415 . . . . 0.53 111.303 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -116.16 166.78 11.64 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.234 -0.483 . . . . 0.76 110.395 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.427 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 5.6 t -110.27 147.61 33.52 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.11 -0.496 . . . . 0.52 110.048 179.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.453 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -77.35 -47.3 20.28 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.088 -0.505 . . . . 3.36 110.192 177.177 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.5 m -62.16 -36.13 80.92 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.773 0.286 . . . . 1.37 111.773 -178.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.427 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 96.6 mt-30 -55.0 -28.0 48.53 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.864 0.364 . . . . 1.11 111.908 -178.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.476 ' O ' ' HB2' ' A' ' 124' ' ' SER . 35.9 m-85 -116.6 -14.93 10.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.353 -0.385 . . . . 1.28 111.512 -175.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.58 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 50.8 m -101.37 153.56 19.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.727 0.775 . . . . 1.81 112.581 -176.179 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.436 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.2 t70 -125.8 -10.92 6.68 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.116 -1.402 . . . . 2.31 109.766 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.806 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.2 m -46.97 -71.26 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.926 -1.488 . . . . 0.92 113.1 -166.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.806 ' H ' HG23 ' A' ' 30' ' ' VAL . 8.1 pt-20 -99.32 1.82 44.85 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.203 -0.666 . . . . 2.74 109.203 177.303 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.436 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.7 tt0 -66.64 -52.91 39.78 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.078 -0.964 . . . . 1.45 111.457 -175.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -103.04 -3.34 26.11 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.488 0.551 . . . . 1.87 112.488 -171.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 34' ' ' ARG . 18.4 ptt-85 -155.6 151.14 27.17 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.936 0.398 . . . . 3.39 111.182 175.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.6 p -132.32 106.09 7.7 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.467 0.651 . . . . 2.25 111.328 179.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.665 ' HG3' ' H ' ' A' ' 37' ' ' ALA . 12.2 pt-20 -95.64 -65.7 0.96 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.396 -0.82 . . . . 3.34 110.35 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.665 ' H ' ' HG3' ' A' ' 36' ' ' GLU . . . -64.61 155.21 82.49 Favored Pre-proline 0 C--N 1.309 -1.179 0 CA-C-N 114.607 -1.178 . . . . 1.92 110.467 172.179 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.5 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 32.3 Cg_exo -60.03 178.43 0.4 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.111 2.541 . . . . 1.87 112.708 176.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.72 -0.21 14.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.352 0.596 . . . . 4.64 110.406 179.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.529 ' HA3' ' HB2' ' A' ' 44' ' ' GLU . . . 143.78 70.02 0.02 OUTLIER Glycine 0 N--CA 1.439 -1.123 0 N-CA-C 110.988 -0.845 . . . . 2.15 110.988 179.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.635 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.3 OUTLIER -66.14 -71.98 0.18 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 120.711 -0.395 . . . . 1.12 110.035 -176.869 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.64 ' CD ' ' H ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -91.62 -36.74 13.48 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 122.017 0.913 . . . . 2.02 109.515 171.209 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.793 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 75.0 m -69.07 -23.92 64.09 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 113.772 -1.558 . . . . 1.25 114.595 -165.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.529 ' HB2' ' HA3' ' A' ' 40' ' ' GLY . 33.9 tt0 -56.95 -44.31 82.41 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 119.889 -0.724 . . . . 1.91 110.159 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.529 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -75.64 -39.71 57.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.017 0.436 . . . . 0.52 110.335 175.26 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.793 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 60.1 t -54.94 -60.38 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.508 -0.769 . . . . 1.41 111.671 178.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.611 ' NZ ' ' HB3' ' A' ' 7' ' ' GLU . 15.1 ptpt -60.07 -34.94 74.12 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.273 -0.64 . . . . 0.67 109.273 -178.28 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.427 ' OE1' ' HD2' ' A' ' 51' ' ' ARG . 22.8 mm-40 -66.6 -32.47 73.83 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.763 -0.653 . . . . 0.99 111.054 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.724 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -81.48 -35.67 30.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.351 0.596 . . . . 0.42 110.315 176.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.715 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.5 mp -66.56 -22.92 66.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.49 -0.777 . . . . 1.33 111.996 -177.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.539 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 8.3 ptp180 -86.18 -27.94 24.23 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.106 -0.702 . . . . 2.17 109.106 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.715 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.1 mm-40 -70.12 -47.93 59.66 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.653 -1.158 . . . . 1.1 109.524 174.418 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.416 ' HB2' ' HD2' ' A' ' 155' ' ' TYR . . . -68.02 -38.88 83.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.447 -0.797 . . . . 0.53 110.268 174.55 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.68 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -61.84 -42.78 99.78 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.51 -0.768 . . . . 0.7 112.489 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -54.08 -44.6 71.29 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.883 0.373 . . . . 1.04 111.04 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.415 ' HA ' ' CD2' ' A' ' 59' ' ' LEU . 37.3 mt-10 -63.38 -29.22 70.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.934 -0.575 . . . . 2.29 111.388 178.36 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.524 ' HZ ' HD12 ' B' 1008 ' ' LEU . 71.3 t80 -77.5 -39.87 44.82 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.207 -0.451 . . . . 2.29 110.294 177.588 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.68 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.4 mt-10 -62.81 -46.89 85.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.868 -0.605 . . . . 1.3 111.067 -176.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.514 HD12 ' N ' ' A' ' 60' ' ' ARG . 4.5 pp -59.25 -33.08 70.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.215 -0.448 . . . . 1.54 112.028 -175.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.514 ' N ' HD12 ' A' ' 59' ' ' LEU . 5.7 ptp85 -87.34 -35.38 18.42 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.332 -0.547 . . . . 2.58 112.353 -174.25 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.546 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 0.9 OUTLIER -91.63 -5.71 53.42 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 120.732 -0.387 . . . . 5.32 111.299 -178.436 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 58' ' ' GLU . 69.2 ttt180 -55.86 -32.5 63.7 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.285 -0.416 . . . . 4.48 111.644 -174.239 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -54.34 -39.35 67.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.837 -0.62 . . . . 4.72 111.96 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.409 ' HB1' HD13 ' A' ' 68' ' ' LEU . . . -90.72 -28.83 18.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.549 -0.296 . . . . 1.17 111.736 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.672 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 28.0 t80 -51.82 -38.55 56.24 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.86 0.689 . . . . 2.81 112.86 -172.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.1 p -72.03 -34.83 69.11 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.859 0.318 . . . . 2.19 111.859 -176.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -90.43 -32.21 16.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.914 0.388 . . . . 2.72 111.226 -175.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.44 ' HA ' ' HG3' ' A' ' 71' ' ' GLN . 3.6 mp -60.51 -17.35 44.98 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 112.864 0.69 . . . . 1.56 112.864 -175.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.528 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 3.0 p -58.9 -35.73 73.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 118.794 0.725 . . . . 0.7 110.403 -178.314 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.1 m -65.93 -28.59 69.04 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.192 -0.913 . . . . 1.34 110.437 175.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.44 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 34.0 mt-30 -86.9 -36.16 18.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.341 -0.845 . . . . 1.42 110.249 -177.436 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.565 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.4 mm? -65.39 -32.53 74.2 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 109.077 -0.712 . . . . 1.37 109.077 169.578 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.466 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 32.7 m80 66.11 39.01 4.49 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.292 -1.003 . . . . 2.72 108.292 -173.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.656 HG22 ' HE1' ' A' ' 119' ' ' MET . 29.0 mm -45.18 117.34 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 113.634 -1.621 . . . . 0.91 112.316 -177.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.762 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.7 -171.34 0.27 Allowed Pre-proline 0 N--CA 1.442 -0.872 0 CA-C-N 114.574 -1.194 . . . . 0.51 108.019 -171.078 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.762 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 52.7 Cg_exo -28.62 166.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.364 1.35 0 C-N-CA 125.299 3.999 . . . . 0.47 115.628 165.46 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.46 -30.34 0.01 OUTLIER Glycine 0 N--CA 1.47 0.962 0 N-CA-C 117.449 1.74 . . . . 0.4 117.449 -172.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.472 ' HA ' ' CD1' ' A' ' 80' ' ' TYR . 28.2 p -67.07 6.4 0.54 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.942 0.871 . . . . 0.56 112.576 -178.506 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.01 -10.4 57.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.327 0.584 . . . . 0.34 110.138 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.472 ' CD1' ' HA ' ' A' ' 78' ' ' THR . 4.9 p90 -73.97 -19.1 60.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.761 -0.654 . . . . 4.13 109.835 175.398 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.598 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 25.9 mt-30 -87.48 -18.27 30.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.763 0.792 . . . . 1.03 110.288 174.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.1 m -75.88 -53.42 8.46 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.663 -1.153 . . . . 0.48 108.844 170.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.442 ' CD2' ' HZ3' ' A' ' 129' ' ' TRP . 90.2 t80 -65.66 -15.39 62.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.85 -1.068 . . . . 1.18 110.06 174.017 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.632 ' HA ' HG12 ' A' ' 87' ' ' VAL . 28.7 tt0 -60.78 -49.08 78.91 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 121.773 0.797 . . . . 0.8 110.111 176.242 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.454 ' H ' ' HG2' ' A' ' 85' ' ' GLN . 62.8 mm-40 -50.16 -37.58 35.37 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.731 -1.577 . . . . 1.62 112.0 -176.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.571 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 3.6 p -91.62 -42.45 13.67 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 114.633 -1.167 . . . . 1.3 111.799 -176.594 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.632 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.9 p -59.71 -24.07 28.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 122.077 0.941 . . . . 0.85 109.399 176.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.3 m-80 -71.51 -39.78 70.58 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.037 -1.438 . . . . 0.91 111.691 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.762 ' HA ' ' HD2' ' A' ' 92' ' ' ARG . 1.6 pp20? -77.9 -32.44 51.76 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.53 0.681 . . . . 2.87 109.653 -179.071 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.619 HD12 HH11 ' A' ' 99' ' ' ARG . 0.2 OUTLIER -61.71 -30.97 71.11 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.214 -1.357 . . . . 1.28 112.008 -165.912 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.409 ' HA ' ' HB ' ' A' ' 95' ' ' VAL . 17.2 p90 -107.41 -30.06 8.89 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.208 0.447 . . . . 2.3 112.208 -175.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.762 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -65.27 -22.05 66.8 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.066 0.46 . . . . 5.06 111.901 -169.306 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.503 ' N ' ' HD3' ' A' ' 92' ' ' ARG . 28.1 t70 -92.91 -13.86 28.36 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.795 -0.638 . . . . 3.12 111.67 -172.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.16 69.78 0.11 Allowed Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 118.862 -1.637 . . . . 2.31 112.805 -173.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.562 HG13 ' CD1' ' A' ' 141' ' ' TRP . 0.1 OUTLIER -67.77 109.81 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 122.992 1.377 . . . . 1.06 110.499 -173.576 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.422 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 2.8 p30 -108.04 -170.89 1.76 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 113.391 -1.731 . . . . 2.12 109.653 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.97 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 15.8 m-90 -54.9 -42.64 72.41 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.571 -0.74 . . . . 3.34 110.664 177.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -77.27 -30.32 54.71 Favored Glycine 0 N--CA 1.452 -0.282 0 CA-C-N 115.909 -0.587 . . . . 0.69 113.567 -174.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.754 HH12 ' HA ' ' B' 1009 ' ' ALA . 16.5 mmt180 -59.97 -36.61 77.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.314 0.578 . . . . 4.24 111.368 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.472 HG12 ' HG ' ' A' ' 138' ' ' LEU . 94.5 mt -78.0 -32.35 17.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.601 -0.727 . . . . 0.44 111.895 -173.249 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.442 HG22 HD13 ' B' 1015 ' ' ILE . 1.6 m -65.16 -22.97 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.401 0.619 . . . . 1.35 110.197 174.431 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.75 -42.85 19.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.205 0.526 . . . . 0.44 110.049 175.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.422 ' CE1' HG23 ' A' ' 87' ' ' VAL . 22.5 t80 -54.71 -55.11 33.34 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.891 -1.05 . . . . 1.49 111.358 177.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.715 ' CZ ' ' HB3' ' A' ' 50' ' ' LEU . 0.2 OUTLIER -70.87 -20.56 62.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.014 0.435 . . . . 3.29 110.292 -176.501 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.699 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 33.7 t -73.02 -50.61 22.1 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.927 -0.579 . . . . 1.19 110.362 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.461 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 18.2 t80 -70.28 -26.8 63.97 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 116.512 -0.313 . . . . 2.89 110.216 -178.184 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.722 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -70.44 -36.03 68.97 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.215 -0.993 . . . . 0.3 111.38 174.586 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.811 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -69.22 -33.88 74.32 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 110.855 -0.898 . . . . 0.23 110.855 173.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.672 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -69.81 -33.61 72.57 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.136 -0.532 . . . . 0.31 110.643 175.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.595 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -59.19 -39.78 83.67 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.253 1.025 . . . . 1.12 108.625 -179.723 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.641 ' SG ' HG22 ' A' ' 123' ' ' VAL . 35.6 t -53.0 -53.82 44.4 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 113.622 -1.626 . . . . 0.26 110.604 173.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.46 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 93.5 t -65.8 -38.44 82.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.261 -0.427 . . . . 0.35 111.07 -178.228 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.528 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 31.1 mt-10 -56.1 -34.06 65.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.015 0.436 . . . . 2.51 110.287 175.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.445 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 45.9 m -74.64 -39.13 62.28 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.412 0.625 . . . . 0.28 109.333 178.689 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 111' ' ' CYS . 91.0 t -66.37 -34.37 69.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.095 -0.957 . . . . 1.23 109.565 -179.305 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -52.12 -48.89 64.57 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.575 -1.648 . . . . 0.6 111.196 178.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.41 ' HB2' ' HG3' ' A' ' 119' ' ' MET . 28.7 mmtt -88.05 12.47 13.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.718 -0.674 . . . . 1.62 110.419 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 60.11 46.31 10.78 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.876 0.846 . . . . 1.88 110.714 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.656 ' HE1' HG22 ' A' ' 74' ' ' ILE . 27.3 mtm -118.69 45.86 1.96 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.462 -1.244 . . . . 0.31 107.738 178.376 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.407 ' HA ' HG23 ' A' ' 123' ' ' VAL . 1.0 OUTLIER -61.01 -7.28 2.36 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.373 -1.285 . . . . 1.15 113.156 -175.174 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.55 HG23 HD22 ' A' ' 122' ' ' LEU . 28.3 m -66.61 -25.8 35.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 O-C-N 122.025 -0.422 . . . . 0.46 111.197 173.382 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.772 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.4 mm? -71.91 -27.05 62.57 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 110.268 -0.271 . . . . 0.26 110.268 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.641 HG22 ' SG ' ' A' ' 111' ' ' CYS . 60.7 t -43.48 -53.6 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 123.777 0.673 . . . . 0.25 112.184 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.58 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 4.8 t -75.11 -34.62 61.73 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.749 -0.38 . . . . 1.35 110.542 -179.319 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.772 ' HD2' HD13 ' A' ' 122' ' ' LEU . 82.4 mtt180 -63.83 -51.6 63.93 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.243 -0.435 . . . . 2.67 110.787 -177.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.65 ' O ' ' HB2' ' A' ' 130' ' ' MET . 89.7 mt -54.52 -47.79 70.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.878 -0.601 . . . . 0.23 110.663 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.663 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.93 -25.53 57.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.239 -0.437 . . . . 0.29 111.962 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.704 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -68.75 -67.03 0.5 Allowed 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 121.117 0.484 . . . . 0.28 110.356 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.634 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 37.6 p-90 -75.69 -17.28 60.0 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.318 -0.855 . . . . 3.91 111.809 -176.132 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.722 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 0.3 OUTLIER -65.09 -44.68 88.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.428 . . . . 1.08 109.977 173.143 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.474 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -72.65 -38.87 67.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.385 -0.371 . . . . 0.25 110.125 176.739 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.597 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 38.0 m -59.76 -45.25 92.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.064 -0.517 . . . . 0.4 111.678 175.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.429 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 0.7 OUTLIER -56.11 -41.24 74.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.807 0.337 . . . . 3.13 110.578 177.693 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.788 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.4 tt -62.52 -50.54 70.98 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.864 -0.791 . . . . 0.95 108.864 173.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ASN . . . . . 0.427 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 5.2 m-80 -51.26 -48.57 62.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.879 -0.6 . . . . 0.46 112.398 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -80.99 -50.42 9.72 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.294 0.479 . . . . 0.59 112.294 -175.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' HIS . . . . . 0.429 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 1.7 m80 -90.64 -51.58 5.32 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.656 0.613 . . . . 1.45 112.656 -171.156 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.788 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -81.47 -46.98 13.76 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.612 0.968 . . . . 1.2 113.612 -168.644 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.768 ' HA ' HD12 ' A' ' 142' ' ' ILE . 34.1 tt0 -44.19 -52.92 14.94 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 113.259 0.837 . . . . 0.75 113.259 -172.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.6 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 38.8 Cg_exo -59.5 -44.23 33.97 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 121.647 1.565 . . . . 0.56 111.529 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' TRP . . . . . 0.562 ' CD1' HG13 ' A' ' 95' ' ' VAL . 1.5 t-105 -63.79 -42.93 97.63 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.48 -0.782 . . . . 1.2 110.203 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.768 HD12 ' HA ' ' A' ' 139' ' ' GLU . 49.5 mt -48.68 -50.25 13.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.053 0.454 . . . . 0.32 111.128 173.391 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.5 mm-40 -59.96 -31.79 70.21 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.521 -0.763 . . . . 0.57 111.46 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.2 mm-40 -65.14 -19.42 65.97 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.599 0.714 . . . . 0.78 110.733 176.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -111.16 5.14 19.85 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.198 -0.91 . . . . 0.93 110.408 -175.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 117.17 -42.26 1.9 Allowed Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.626 -0.715 . . . . 0.56 113.071 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' GLY . . . . . 0.583 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 132.8 -176.2 19.61 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.369 -0.92 . . . . 0.49 112.343 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.678 ' HZ2' ' HG3' ' A' ' 139' ' ' GLU . 12.9 m-90 -73.16 -47.24 45.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.046 0.451 . . . . 3.57 110.495 -177.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -59.85 -41.42 91.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.654 -0.703 . . . . 1.96 110.494 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.594 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 86.3 m -56.1 -35.22 66.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.924 -0.58 . . . . 0.67 111.404 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.97 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 64.4 t80 -61.1 -45.12 96.0 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.875 -0.33 . . . . 3.0 110.202 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.591 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -70.49 -24.6 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.474 0.654 . . . . 1.15 109.869 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -66.81 -22.99 66.0 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.276 -0.42 . . . . 1.67 110.403 173.296 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.1 mt -98.03 -55.84 2.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.296 0.57 . . . . 1.3 110.88 178.141 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' TYR . . . . . 0.416 ' HD2' ' HB2' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -121.7 27.41 8.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.439 -0.8 . . . . 4.24 110.416 -170.712 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.724 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -58.14 167.0 6.21 Favored Glycine 0 CA--C 1.503 -0.709 0 CA-C-O 121.834 0.686 . . . . 1.1 114.24 -178.042 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.715 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 28.5 t-20 -54.43 130.01 37.89 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 113.68 -1.26 . . . . 1.29 111.224 -177.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.716 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 4.1 m120 -65.39 -28.39 69.23 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.502 0.556 . . . . 2.99 112.502 -173.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.453 ' HB3' ' OD1' ' A' ' 157' ' ' ASN . . . -60.56 -29.41 69.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.163 0.506 . . . . 2.52 110.32 176.494 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -87.06 -36.68 18.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.099 -0.501 . . . . 2.87 110.206 174.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.541 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -59.77 -50.57 73.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.891 -0.595 . . . . 3.2 111.354 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.716 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 9.2 pt-20 -60.27 -27.5 67.3 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.637 -0.256 . . . . 3.72 111.378 176.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 18.1 t -67.77 -40.55 84.01 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.629 -0.508 . . . . 4.18 109.629 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 4.6 mpt_? -80.89 -0.32 38.62 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 121.203 0.525 . . . . 5.82 110.52 176.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.402 ' HB3' ' O ' ' A' ' 162' ' ' GLU . 38.9 ttmt -86.85 -13.59 44.52 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.979 -0.555 . . . . 4.77 109.763 176.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -63.82 -17.77 61.04 Favored Glycine 0 N--CA 1.451 -0.303 0 CA-C-N 115.642 -0.708 . . . . 5.1 113.325 -174.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -69.53 -20.88 63.69 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 122.603 -0.351 . . . . 5.72 111.172 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.56 ' HA ' ' O ' ' A' ' 171' ' ' GLU . 25.8 mt-10 -81.23 2.92 25.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.957 0.408 . . . . 5.88 110.686 178.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.428 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 3.5 tmt_? -64.91 -39.74 93.98 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.53 -0.915 . . . . 7.34 108.53 173.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.448 HD22 ' HA ' ' A' ' 170' ' ' LEU . 0.3 OUTLIER -106.0 -47.78 3.77 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.463 -0.789 . . . . 6.97 109.932 176.707 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 171' ' ' GLU . . . . . 0.56 ' O ' ' HA ' ' A' ' 168' ' ' GLU . 40.5 mm-40 -89.07 91.6 8.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.342 0.592 . . . . 6.97 111.455 -177.365 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 63.7 t60 -166.12 24.27 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.551 -0.907 . . . . 9.35 108.551 -178.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 30.3 t-80 -133.34 30.06 3.91 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.389 -0.823 . . . . 11.4 110.278 -174.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 9.1 t-160 -65.75 -28.92 69.39 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.988 0.423 . . . . 11.52 110.061 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -113.78 153.82 28.42 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.106 -0.497 . . . . 14.48 110.227 174.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -83.4 118.99 24.09 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.008 -0.542 . . . . 15.37 109.778 178.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -104.71 107.18 17.99 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.516 -0.311 . . . . 16.02 110.606 -177.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 78.3 mt 62.67 -174.04 0.15 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.582 -0.736 . . . . 17.99 111.291 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -97.51 -6.94 32.54 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.054 0.454 . . . . 19.19 110.234 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -92.94 109.76 21.21 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.928 -0.578 . . . . 22.26 110.068 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -79.91 -51.3 9.29 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.083 -0.508 . . . . 22.51 110.418 -177.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 64.45 87.61 0.11 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.542 -0.754 . . . . 24.89 110.503 -179.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -109.95 92.16 3.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.15 -0.477 . . . . 25.58 110.112 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -116.91 -17.02 10.51 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.016 -0.538 . . . . 27.37 110.139 -178.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.454 -0.784 . . . . 29.06 110.125 179.482 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.109 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . 87.35 -87.34 1.54 Allowed Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.615 -0.802 . . . . 2.97 111.916 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.436 ' HA ' ' C2 ' ' B' 1100 ' ' 33B . 4.6 m 56.78 -149.32 0.47 Allowed 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 122.957 0.503 . . . . 1.94 111.835 176.486 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.736 ' HA ' ' CD2' ' B' 1008 ' ' LEU . 2.7 m 39.72 -88.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.344 0.353 0 C-N-CA 124.961 1.304 . . . . 1.63 113.578 176.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B 1005 ' ' GLY . . . . . 0.509 ' H ' HG23 ' B' 1004 ' ' VAL . . . -33.91 -33.48 0.02 OUTLIER Glycine 0 CA--C 1.536 1.405 0 CA-C-N 117.989 0.359 . . . . 1.2 113.977 165.41 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B 1006 ' ' ARG . . . . . 0.419 ' O ' ' HB3' ' B' 1009 ' ' ALA . 18.4 mmt180 -107.38 -37.04 6.34 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.672 0.619 . . . . 2.88 112.672 177.358 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B 1007 ' ' ALA . . . . . 0.581 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -71.34 -61.6 1.71 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.884 0.698 . . . . 1.31 112.884 -165.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.736 ' CD2' ' HA ' ' B' 1004 ' ' VAL . 1.9 mm? -61.86 -41.96 98.47 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.138 -0.689 . . . . 1.33 109.138 -177.518 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B 1009 ' ' ALA . . . . . 0.754 ' HA ' HH12 ' A' ' 99' ' ' ARG . . . -38.48 -56.87 1.22 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.333 -1.303 . . . . 0.88 111.645 169.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.739 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -73.51 -42.58 61.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.535 -1.211 . . . . 1.03 112.005 -174.003 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.611 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 31.0 m-85 -70.86 -20.79 62.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.062 -0.517 . . . . 1.67 111.476 -177.081 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -75.52 -23.39 73.31 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.841 -0.695 . . . . 0.78 112.928 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.75 -19.51 62.53 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.988 0.423 . . . . 1.9 111.09 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 18.6 m -87.03 -14.4 41.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.335 -0.393 . . . . 1.44 111.2 -173.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.442 HD13 HG22 ' A' ' 101' ' ' VAL . 56.8 mt -76.1 -70.56 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 110.008 -0.367 . . . . 2.91 110.008 -178.305 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -124.52 95.73 4.64 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.157 -0.474 . . . . 4.29 109.835 176.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 13.1 tpt180 -91.13 -71.78 0.61 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.033 -0.531 . . . . 8.17 110.376 178.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 116.697 -0.228 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.753 ' O62' ' C2 ' ' B' 1100 ' ' 33B . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.657 ' HG3' HG21 ' A' ' 41' ' ' THR . 26.5 mmt . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 109.828 -0.434 . . . . 6.21 109.828 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.0 t -132.82 -24.09 1.97 Allowed 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.924 -0.31 . . . . 1.87 111.441 -179.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.7 tp60 -100.38 1.19 41.17 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.333 0.587 . . . . 2.42 110.714 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.5 p -71.12 -12.33 61.44 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.975 -0.557 . . . . 1.25 111.388 -179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.893 ' HA ' HD22 ' A' ' 8' ' ' LEU . 3.4 p30 -66.29 -25.39 66.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.817 -0.628 . . . . 1.78 111.043 176.283 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.641 ' NH1' ' HB ' ' A' ' 30' ' ' VAL . 15.0 tpp85 -55.62 -50.37 70.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.933 -0.576 . . . . 1.4 110.618 175.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.471 ' OE1' ' HA2' ' A' ' 40' ' ' GLY . 34.7 mt-10 -59.41 -49.51 77.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.444 -0.798 . . . . 0.68 111.007 -176.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.893 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.1 OUTLIER -47.73 -39.45 17.75 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.102 -0.954 . . . . 1.16 111.287 176.874 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.3 t -73.13 -62.08 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.122 0.487 . . . . 0.27 110.253 176.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 6' ' ' ARG . 86.1 t -49.88 -49.15 21.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.17 -0.923 . . . . 0.33 113.092 -176.288 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -53.72 -37.21 63.09 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.797 0.332 . . . . 0.59 110.845 -176.027 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.608 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 21.5 t80 -78.47 -44.2 25.18 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.293 -0.412 . . . . 1.61 111.007 -178.199 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.809 HD22 ' HB2' ' A' ' 127' ' ' ALA . 6.1 mp -58.03 -42.7 85.88 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 120.435 -0.506 . . . . 0.34 109.905 177.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.1 t -58.95 -44.91 91.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.79 -0.641 . . . . 1.05 110.594 177.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.438 ' O ' ' HB3' ' A' ' 18' ' ' SER . 61.3 t80 -69.18 -29.61 67.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.971 -0.559 . . . . 1.22 110.844 -178.305 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.67 ' HE2' ' HA ' ' A' ' 16' ' ' LYS . 9.5 mmpt? -74.58 -32.24 62.32 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 120.666 0.27 . . . . 1.41 110.879 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.619 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -68.4 -28.17 66.86 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 120.283 -0.567 . . . . 1.35 109.626 174.737 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.438 ' HB3' ' O ' ' A' ' 15' ' ' TYR . 45.1 t -62.5 -36.17 81.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.651 -0.704 . . . . 0.94 112.06 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -79.07 -0.01 29.71 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.367 0.604 . . . . 1.37 111.243 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.609 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 19.9 mmmt -112.97 -28.66 7.63 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.783 0.801 . . . . 2.2 109.09 178.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.36 21.1 11.02 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.119 -1.401 . . . . 0.53 111.569 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.609 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 94.4 m-85 -110.2 167.24 10.34 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.571 -0.314 . . . . 0.76 110.24 178.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.586 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 6.6 t -111.47 149.97 30.56 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.034 0.445 . . . . 0.52 110.866 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.588 ' HZ2' ' HG2' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -65.47 -50.4 65.48 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.474 -0.785 . . . . 3.36 110.379 173.555 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.9 t -70.42 -24.63 62.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 1.37 111.588 -172.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.586 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 92.7 mt-30 -57.7 -32.29 67.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.006 0.432 . . . . 1.11 110.997 177.535 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.512 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 16.4 m-85 -114.76 -16.44 11.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.1 -0.5 . . . . 1.28 111.674 -173.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.608 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 24.8 m -100.97 152.04 21.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.721 0.772 . . . . 1.81 112.661 -175.1 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.476 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 2.7 t70 -127.81 -8.69 5.54 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.244 -1.344 . . . . 2.31 109.842 -177.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.819 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.3 m -51.39 -72.88 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.196 -1.365 . . . . 0.92 113.041 -169.187 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.819 ' H ' HG23 ' A' ' 30' ' ' VAL . 1.7 pm0 -100.57 3.04 42.38 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.089 0.471 . . . . 2.74 110.337 174.388 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.476 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 19.7 tt0 -58.25 -53.75 54.75 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.618 -0.719 . . . . 1.45 111.324 178.545 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -87.11 -58.98 2.38 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.818 -0.628 . . . . 1.87 111.445 -172.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.0 ptt180 -98.96 141.5 31.65 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.985 0.422 . . . . 3.39 109.881 175.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 4.2 p -117.54 98.87 6.62 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 121.711 0.767 . . . . 2.25 110.942 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 1.004 ' HG3' ' H ' ' A' ' 37' ' ' ALA . 11.2 pt-20 -93.29 -72.3 0.61 Allowed 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 114.624 -1.171 . . . . 3.34 110.496 -176.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 1.004 ' H ' ' HG3' ' A' ' 36' ' ' GLU . . . -63.54 162.73 24.5 Favored Pre-proline 0 C--N 1.308 -1.202 0 CA-C-N 114.119 -1.401 . . . . 1.92 112.164 178.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.769 ' HG3' ' HB ' ' A' ' 41' ' ' THR . 47.7 Cg_endo -64.25 -178.98 0.71 Allowed 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 124.622 3.548 . . . . 1.87 112.89 176.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -87.21 -5.49 58.95 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.868 -0.79 . . . . 4.64 108.868 168.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.667 ' H ' ' HB2' ' A' ' 38' ' ' PRO . . . 156.29 72.91 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 114.947 -1.024 . . . . 2.15 111.771 -179.211 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.958 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.8 t -60.88 -74.42 0.08 Allowed 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 109.961 -0.385 . . . . 1.12 109.961 -177.054 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.958 ' H ' HG23 ' A' ' 41' ' ' THR . 11.2 pt-20 -94.98 -29.05 14.83 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 122.96 1.362 . . . . 2.02 108.211 164.423 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.59 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.0 OUTLIER -62.91 -26.3 68.73 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 112.021 -2.354 . . . . 1.25 114.107 -166.951 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.583 ' HB2' ' HA3' ' A' ' 40' ' ' GLY . 42.2 tt0 -55.56 -42.23 74.4 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.918 -0.313 . . . . 1.91 110.411 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.542 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -79.48 -37.33 37.03 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.97 0.414 . . . . 0.52 110.354 176.274 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.673 ' HA ' ' CG1' ' A' ' 152' ' ' VAL . 99.7 t -58.11 -60.96 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.683 -0.69 . . . . 1.41 111.353 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.476 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 10.6 ptpt -59.41 -34.62 72.69 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.365 -0.605 . . . . 0.67 109.365 -178.097 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.51 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 22.2 mm-40 -66.59 -32.44 73.78 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.439 -0.801 . . . . 0.99 111.01 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.762 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -82.88 -35.02 26.55 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.303 0.573 . . . . 0.42 110.3 176.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.451 HD12 ' CE2' ' A' ' 151' ' ' PHE . 1.1 tp -63.06 -31.38 72.51 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.245 -0.889 . . . . 1.33 111.468 -177.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.476 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 9.5 ptp180 -79.05 -30.24 43.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.661 0.743 . . . . 2.17 109.098 -178.404 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.647 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.4 mm-40 -68.9 -47.93 64.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.58 -1.191 . . . . 1.1 109.799 177.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.2 -36.8 82.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.427 -0.806 . . . . 0.53 110.073 174.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.707 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.73 -44.05 98.4 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.46 -0.791 . . . . 0.7 112.144 179.097 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.447 ' O ' HD22 ' A' ' 59' ' ' LEU . 23.9 t70 -55.2 -39.65 69.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.785 0.326 . . . . 1.04 110.774 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.41 ' O ' HD21 ' A' ' 59' ' ' LEU . 57.3 mm-40 -65.38 -26.45 68.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.36 -0.836 . . . . 2.29 111.658 178.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -82.84 -33.51 27.09 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.516 -0.311 . . . . 2.29 111.205 175.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.772 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 38.2 mt-10 -69.4 -53.37 19.76 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 112.374 0.509 . . . . 1.3 112.374 -165.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.533 HD23 ' N ' ' A' ' 59' ' ' LEU . 2.3 pt? -52.31 -35.18 49.99 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 123.608 0.568 . . . . 1.54 110.477 -177.08 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 75.7 mtt180 -61.4 -58.86 6.48 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.424 -0.807 . . . . 2.58 112.055 -178.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.772 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 8.9 p90 -91.32 -6.57 52.9 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.028 0.381 . . . . 5.32 112.028 -173.255 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 58' ' ' GLU . 17.7 tpp85 -62.84 -30.77 71.75 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.95 0.352 . . . . 4.48 111.95 -171.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -65.16 -39.88 93.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.907 0.384 . . . . 4.72 110.196 178.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.432 ' HB1' ' CD1' ' A' ' 68' ' ' LEU . . . -77.21 -41.27 41.98 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.025 -0.534 . . . . 1.17 110.858 176.563 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.683 ' CZ ' ' HB1' ' A' ' 109' ' ' ALA . 39.4 t80 -43.42 -47.94 7.06 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.959 0.725 . . . . 2.81 112.959 -174.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.3 p -60.01 -37.17 78.95 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.785 0.326 . . . . 2.19 111.627 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -86.49 -29.62 22.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.311 0.576 . . . . 2.72 110.642 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.432 ' CD1' ' HB1' ' A' ' 64' ' ' ALA . 2.0 mp -59.73 -16.87 30.44 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.27 -0.877 . . . . 1.56 112.596 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.487 HG22 HG13 ' A' ' 74' ' ' ILE . 2.2 p -57.88 -27.81 63.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.839 0.291 . . . . 0.7 111.686 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -71.99 -33.75 68.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.652 0.739 . . . . 1.34 109.327 174.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -77.03 -38.39 52.97 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.123 -0.944 . . . . 1.42 110.036 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.708 HD21 ' HZ ' ' A' ' 106' ' ' PHE . 3.1 mm? -65.87 -32.87 74.63 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.559 -0.292 . . . . 1.37 110.514 172.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 59.7 m80 63.25 41.08 8.17 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.332 -0.988 . . . . 2.72 108.332 -172.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.644 HG22 ' HE1' ' A' ' 119' ' ' MET . 31.5 mm -46.71 115.22 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 113.975 -1.466 . . . . 0.91 112.057 -177.712 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.725 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.15 -174.83 0.45 Allowed Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 114.746 -1.115 . . . . 0.51 108.117 -168.234 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.725 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 23.4 Cg_exo -30.3 166.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 125.166 3.911 . . . . 0.47 115.001 165.203 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.595 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -28.82 -34.01 0.01 OUTLIER Glycine 0 N--CA 1.469 0.895 0 N-CA-C 116.931 1.532 . . . . 0.4 116.931 -170.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.448 ' N ' ' O ' ' A' ' 76' ' ' PRO . 22.2 p -62.32 3.87 0.17 Allowed 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.893 0.701 . . . . 0.56 112.893 -179.383 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.54 -13.16 62.19 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.207 0.527 . . . . 0.34 109.927 172.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.595 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 10.5 p90 -75.91 -18.29 59.44 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.526 -0.546 . . . . 4.13 109.526 174.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.462 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 93.8 mt-30 -77.57 -32.55 53.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.878 0.847 . . . . 1.03 109.135 172.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.9 m -68.37 -52.28 34.89 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.283 -1.326 . . . . 0.48 109.797 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -68.99 -17.97 63.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.046 -0.979 . . . . 1.18 110.349 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.57 ' HA ' HG12 ' A' ' 87' ' ' VAL . 44.3 tt0 -64.47 -48.78 73.97 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.02 -0.536 . . . . 0.8 110.502 177.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.469 ' OE1' HG21 ' B' 1004 ' ' VAL . 56.8 mt-30 -46.48 -35.45 5.67 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.715 -1.13 . . . . 1.62 110.302 176.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.742 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.4 t -81.47 -54.82 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.018 0 CA-C-N 114.455 -1.248 . . . . 1.3 111.069 -176.268 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.57 HG12 ' HA ' ' A' ' 84' ' ' GLU . 10.6 p -58.11 -26.39 29.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.591 0.71 . . . . 0.85 109.567 -178.729 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.489 ' O ' ' HB3' ' A' ' 92' ' ' ARG . 2.3 m-80 -68.07 -40.87 82.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.521 -1.218 . . . . 0.91 111.833 175.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.951 ' HG2' ' HA2' ' B' 1005 ' ' GLY . 0.3 OUTLIER -79.41 -33.54 42.59 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-O 121.691 0.758 . . . . 2.87 109.756 179.259 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.697 ' HA ' ' NH1' ' A' ' 99' ' ' ARG . 42.3 mt -68.31 -22.22 64.72 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 114.392 -1.277 . . . . 1.28 112.146 -168.304 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.556 ' HD1' ' O ' ' A' ' 87' ' ' VAL . 6.2 p90 -108.75 -24.76 11.16 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.719 -0.392 . . . . 2.3 111.93 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.639 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -68.45 -25.69 65.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.823 0.344 . . . . 5.06 111.685 -171.719 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.435 ' HB2' ' NE ' ' A' ' 92' ' ' ARG . 26.8 t70 -97.61 -1.27 44.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.198 -0.456 . . . . 3.12 111.945 -170.302 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.03 67.86 0.11 Allowed Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 118.847 -1.644 . . . . 2.31 113.335 -176.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.594 HG13 ' CD1' ' A' ' 141' ' ' TRP . 0.2 OUTLIER -70.54 100.61 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 123.045 1.402 . . . . 1.06 110.85 -177.485 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.539 ' HA ' HD22 ' A' ' 145' ' ' ASN . 1.2 p30 -110.19 -171.53 1.85 Allowed 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 113.124 -1.853 . . . . 2.12 108.782 172.108 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.691 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 16.0 m-90 -46.09 -52.37 12.17 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.732 0.645 . . . . 3.34 110.964 178.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.43 ' HA3' HD13 ' B' 1015 ' ' ILE . . . -65.43 -28.14 73.26 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.362 -0.835 . . . . 0.69 114.414 -175.104 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.747 HH12 ' HA ' ' B' 1009 ' ' ALA . 12.7 mmt180 -72.22 -38.0 69.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.156 0.478 . . . . 4.24 111.176 -175.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.555 HG12 ' HG ' ' A' ' 138' ' ' LEU . 94.1 mt -70.29 -33.06 52.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.725 -0.67 . . . . 0.44 110.404 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 97' ' ' TRP . 47.0 t -56.31 -54.59 26.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.356 -0.838 . . . . 1.35 109.935 170.67 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -51.1 -47.58 61.9 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.774 -0.648 . . . . 0.44 111.013 176.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.539 ' HA ' HD13 ' A' ' 90' ' ' LEU . 11.3 t80 -55.3 -53.1 60.43 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.939 -1.028 . . . . 1.49 111.993 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.569 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.2 OUTLIER -76.6 -21.85 55.02 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.794 -0.362 . . . . 3.29 110.685 -175.033 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.608 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 47.1 t -70.08 -54.66 12.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 1.19 110.615 177.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.708 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 41.9 t80 -64.31 -26.6 68.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.039 0.447 . . . . 2.89 109.873 178.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.499 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -69.72 -46.96 51.44 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.809 -0.632 . . . . 0.3 112.653 178.016 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.804 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -60.42 -33.46 81.23 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.36 -0.924 . . . . 0.23 110.942 175.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.683 ' HB1' ' CZ ' ' A' ' 65' ' ' PHE . . . -72.11 -30.46 65.09 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.023 -0.589 . . . . 0.31 111.01 176.691 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.7 -42.42 99.63 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.731 -0.84 . . . . 1.12 108.731 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.645 ' SG ' HG13 ' A' ' 123' ' ' VAL . 32.9 t -50.32 -53.22 30.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.915 -1.493 . . . . 0.26 110.933 174.054 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.47 HG11 ' HD3' ' A' ' 20' ' ' LYS . 53.1 t -62.52 -44.64 99.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.884 -0.598 . . . . 0.35 111.962 -176.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.537 ' HB3' HG21 ' A' ' 74' ' ' ILE . 21.2 mm-40 -60.79 -26.04 66.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.929 0.395 . . . . 2.51 111.381 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.501 ' HB3' ' HB2' ' A' ' 122' ' ' LEU . 23.7 m -73.35 -38.51 65.72 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.617 -0.883 . . . . 0.28 108.617 174.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 111' ' ' CYS . 88.2 t -68.73 -37.36 77.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.257 -0.883 . . . . 1.23 109.479 -178.229 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -55.78 -51.02 68.84 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 113.531 -1.668 . . . . 0.6 111.516 -177.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' A' ' 113' ' ' GLU . 15.0 mmtt -85.79 15.89 4.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.937 -0.574 . . . . 1.62 110.071 -178.274 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 65.19 48.32 2.22 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.524 -0.762 . . . . 1.88 110.832 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.644 ' HE1' HG22 ' A' ' 74' ' ' ILE . 25.5 mtm -128.15 43.36 3.15 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.044 -1.095 . . . . 0.31 108.044 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.613 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 0.0 OUTLIER -61.47 -7.69 3.4 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.976 -1.011 . . . . 1.15 113.131 -175.458 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.55 HG23 HD22 ' A' ' 122' ' ' LEU . 25.6 m -66.5 -24.78 33.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 122.042 -0.411 . . . . 0.46 111.079 174.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.643 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -71.7 -27.02 62.74 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 116.537 -0.301 . . . . 0.26 110.19 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.645 HG13 ' SG ' ' A' ' 111' ' ' CYS . 65.5 t -45.97 -54.03 2.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 123.735 0.647 . . . . 0.25 112.116 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.608 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 3.4 t -74.95 -26.02 59.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.901 0.381 . . . . 1.35 110.491 -177.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.643 ' HD2' HD13 ' A' ' 122' ' ' LEU . 91.4 mtt180 -71.5 -53.15 14.85 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.337 -0.392 . . . . 2.67 110.002 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.528 HD12 ' HA ' ' A' ' 111' ' ' CYS . 76.2 mt -54.46 -50.39 58.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.594 -0.73 . . . . 0.23 111.532 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.809 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -57.13 -37.07 71.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.871 0.367 . . . . 0.29 110.967 179.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -61.52 -56.96 14.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.701 0.762 . . . . 0.28 110.241 175.16 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.534 ' CZ2' ' HB3' ' A' ' 125' ' ' ARG . 36.4 m0 -56.79 -46.51 81.49 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.148 -1.387 . . . . 3.91 110.754 -178.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.574 ' SD ' HD11 ' A' ' 13' ' ' LEU . 88.6 mtp -59.36 -54.07 51.0 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.985 -0.552 . . . . 1.08 111.459 -177.732 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.78 -34.24 75.52 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.044 -0.526 . . . . 0.25 110.318 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 54.9 m -65.81 -48.82 70.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.186 -0.461 . . . . 0.4 111.004 175.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.493 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 6.5 m-85 -54.56 -42.58 71.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.438 -0.346 . . . . 3.13 110.471 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.801 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.7 tt -61.59 -50.53 72.21 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 109.029 -0.73 . . . . 0.95 109.029 173.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -50.51 -56.44 11.61 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.247 0.462 . . . . 0.46 112.247 179.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.49 -48.23 15.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.069 0.461 . . . . 0.59 111.866 -171.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' HIS . . . . . 0.493 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 52.4 m-70 -90.49 -51.49 5.38 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 112.7 0.63 . . . . 1.45 112.7 -170.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.801 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -86.07 -42.59 13.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 114.552 1.315 . . . . 1.2 114.552 -165.716 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.654 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 27.5 tt0 -43.85 -51.8 16.38 Favored Pre-proline 0 N--CA 1.47 0.539 0 N-CA-C 112.797 0.666 . . . . 0.75 112.797 -173.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.582 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 47.6 Cg_exo -55.08 -46.06 36.01 Favored 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 121.901 1.734 . . . . 0.56 111.824 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' TRP . . . . . 0.594 ' CD1' HG13 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -61.39 -41.02 96.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.581 -0.736 . . . . 1.2 110.802 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.475 HD12 ' HA ' ' A' ' 139' ' ' GLU . 3.5 mt -54.55 -47.64 71.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.103 0.478 . . . . 0.32 110.628 174.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.654 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 67.0 mm-40 -58.24 -34.19 70.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.415 -0.811 . . . . 0.57 110.916 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.4 mm-40 -65.19 -23.17 67.02 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 121.46 0.647 . . . . 0.78 110.892 178.48 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ASN . . . . . 0.539 HD22 ' HA ' ' A' ' 96' ' ' ASN . 2.3 m-20 -102.12 2.74 37.8 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.164 -0.926 . . . . 0.93 109.315 -174.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.6 -44.14 1.53 Allowed Glycine 0 N--CA 1.439 -1.1 0 CA-C-N 114.813 -1.085 . . . . 0.56 112.436 177.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 138.66 175.78 14.18 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.728 -0.749 . . . . 0.49 111.911 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.416 ' HZ3' ' O ' ' A' ' 1' ' ' MET . 5.5 m-90 -68.27 -43.93 76.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.776 0.322 . . . . 3.57 110.697 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.419 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 23.4 t70 -63.11 -39.65 95.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.115 -0.493 . . . . 1.96 109.908 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.548 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 94.1 m -56.25 -36.67 68.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.605 -0.725 . . . . 0.67 111.069 177.31 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.691 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 75.1 t80 -59.98 -42.97 95.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.837 0.351 . . . . 3.0 110.277 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.673 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.1 m -73.4 -24.75 20.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.408 0.623 . . . . 1.15 110.05 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 8.2 mm-40 -64.49 -23.63 67.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.016 0.436 . . . . 1.67 109.908 173.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 150' ' ' THR . 1.9 mt -98.52 -53.46 3.32 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.964 -0.562 . . . . 1.3 110.768 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -120.79 26.44 9.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.684 -0.689 . . . . 4.24 111.436 -170.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.762 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -57.83 160.2 11.92 Favored Glycine 0 N--CA 1.448 -0.527 0 CA-C-N 116.102 -0.499 . . . . 1.1 113.638 -177.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.647 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 28.7 t-20 -46.44 123.64 5.06 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 113.691 -1.254 . . . . 1.29 112.317 -177.072 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.7 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 4.8 m120 -71.81 -27.46 62.94 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 112.533 0.568 . . . . 2.99 112.533 -173.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -61.39 -40.55 94.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.176 0.513 . . . . 2.52 109.856 175.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.483 ' O ' ' HD3' ' A' ' 164' ' ' ARG . . . -74.13 -36.78 64.2 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.714 -0.675 . . . . 2.87 109.991 174.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.552 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -58.17 -61.79 2.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.94 -0.573 . . . . 3.2 111.382 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.7 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 8.0 pt-20 -55.68 -32.03 62.91 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 111.65 0.241 . . . . 3.72 111.65 176.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 42.5 t -66.73 -45.5 78.47 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.028 0.442 . . . . 4.18 110.285 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' ARG . . . . . 0.483 ' HD3' ' O ' ' A' ' 160' ' ' ALA . 10.0 mpt_? -75.3 -15.2 60.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.354 0.597 . . . . 5.82 110.319 178.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 30.6 ttpt -78.45 -54.22 6.4 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.909 -1.041 . . . . 4.77 110.116 174.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -65.9 -26.89 72.37 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.272 -0.876 . . . . 5.1 113.504 -173.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.43 ' OE1' ' HA ' ' A' ' 164' ' ' ARG . 17.6 pt20 -67.33 -16.67 64.39 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.49 -0.418 . . . . 5.72 110.997 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -82.24 -1.9 50.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.016 0.436 . . . . 5.88 110.295 176.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.505 ' HD2' ' O ' ' A' ' 169' ' ' ARG . 5.7 tmm_? -84.33 -33.29 23.93 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.04 -1.096 . . . . 7.34 108.04 173.738 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -77.79 -48.48 16.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.118 -0.946 . . . . 6.97 109.034 175.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 57.91 91.52 0.04 OUTLIER 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.039 -0.982 . . . . 6.97 111.434 175.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 45.7 m80 -81.71 -11.38 59.07 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.837 -0.62 . . . . 9.35 110.167 178.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -164.58 140.35 5.86 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.4 -0.963 . . . . 11.4 108.4 174.175 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 36.3 m80 -58.02 -53.95 52.43 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.384 0.427 . . . . 11.52 111.742 -174.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -90.89 170.86 9.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.765 0.316 . . . . 14.48 111.293 -177.319 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -54.37 143.67 22.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.668 -0.696 . . . . 15.37 110.922 178.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 9.4 p-80 -144.65 -175.97 4.87 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.87 -0.605 . . . . 16.02 110.27 -177.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.411 HD12 ' N ' ' A' ' 178' ' ' LEU . 6.4 mp -65.83 -48.13 72.72 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 123.177 0.298 . . . . 17.99 111.696 -171.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 61.38 20.81 11.45 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.247 0.342 . . . . 19.19 111.554 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 56.98 37.49 28.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 22.26 110.747 -176.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 -68.34 -24.69 64.84 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-N 115.844 -0.616 . . . . 22.51 109.618 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 29.3 m80 -102.08 96.04 6.74 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.093 -0.706 . . . . 24.89 109.093 171.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -75.06 -35.15 61.87 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.07 -0.514 . . . . 25.58 110.492 -177.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 21.9 p-80 -117.26 148.34 41.75 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.013 -0.366 . . . . 27.37 110.013 178.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 35.8 t-80 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.369 -0.824 . . . . 29.06 110.245 -177.957 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.312 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -97.14 -44.58 2.77 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.809 -0.71 . . . . 2.97 111.949 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.5 ' HA ' ' C2 ' ' B' 1100 ' ' 33B . 31.6 m -113.55 -147.73 0.42 Allowed 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.704 -0.48 . . . . 1.94 109.704 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.974 HG23 ' H ' ' B' 1005 ' ' GLY . 17.6 m 53.07 -100.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 O-C-N 123.933 0.77 . . . . 1.63 112.165 169.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1005 ' ' GLY . . . . . 0.974 ' H ' HG23 ' B' 1004 ' ' VAL . . . -46.21 -19.88 0.46 Allowed Glycine 0 CA--C 1.534 1.252 0 CA-C-N 118.968 0.804 . . . . 1.2 114.512 167.167 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1006 ' ' ARG . . . . . 0.453 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 6.6 mpt_? -98.87 -27.21 14.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 117.537 0.668 . . . . 2.88 112.171 173.454 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1007 ' ' ALA . . . . . 0.488 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -91.96 -65.44 1.01 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.235 0.457 . . . . 1.31 112.235 -169.285 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.603 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 18.2 mt -66.5 -35.91 81.44 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.946 -0.761 . . . . 1.33 108.946 -176.396 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1009 ' ' ALA . . . . . 0.747 ' HA ' HH12 ' A' ' 99' ' ' ARG . . . -42.25 -58.62 2.1 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.681 -1.145 . . . . 0.88 111.351 165.071 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.785 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -72.07 -40.21 68.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.136 -0.938 . . . . 1.03 111.789 -175.225 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.538 ' HE2' ' H8 ' ' B' 1100 ' ' 33B . 36.9 m-85 -67.65 -24.49 65.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.111 0.481 . . . . 1.67 110.397 177.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1012 ' ' GLY . . . . . 0.565 ' O ' HG13 ' B' 1015 ' ' ILE . . . -79.64 -5.1 89.46 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.681 -0.69 . . . . 0.78 112.456 178.587 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 20.8 t70 -74.85 -22.0 58.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.428 0.632 . . . . 1.9 109.685 175.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 28.3 m -80.12 8.43 7.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.571 -0.74 . . . . 1.44 112.33 -173.215 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.565 HG13 ' O ' ' B' 1012 ' ' GLY . 2.7 pp -87.79 4.5 4.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.572 -0.451 . . . . 2.91 110.836 175.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -100.7 154.04 18.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.894 -0.594 . . . . 4.29 109.818 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -105.21 -79.88 0.55 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.818 0.342 . . . . 8.17 110.166 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 116.65 -0.25 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.785 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.47 ' HA ' ' OE1' ' A' ' 42' ' ' GLU . 26.5 ptt? . . . . . 0 N--CA 1.478 0.94 0 CA-C-O 120.569 0.223 . . . . 6.21 110.869 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.3 p -72.12 -57.2 4.46 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.717 0.265 . . . . 1.87 111.717 -174.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.709 ' HG3' ' HB3' ' A' ' 36' ' ' GLU . 37.8 tp60 -73.22 0.93 10.4 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.83 0.348 . . . . 2.42 111.619 -174.015 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.417 ' OG ' ' HB3' ' A' ' 43' ' ' SER . 11.7 t -70.63 -15.2 62.71 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.068 0.461 . . . . 1.25 110.563 176.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.818 ' HA ' HD22 ' A' ' 8' ' ' LEU . 7.2 p30 -56.88 -20.83 25.3 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.269 -0.423 . . . . 1.78 111.226 176.357 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.571 ' HG2' ' HG3' ' A' ' 36' ' ' GLU . 6.8 tpp180 -59.49 -56.2 25.03 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.971 -0.559 . . . . 1.4 110.393 174.513 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.425 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 42.5 mt-10 -57.01 -48.1 79.29 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 115.117 -0.947 . . . . 0.68 110.968 -178.363 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.818 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.1 OUTLIER -49.17 -31.64 8.76 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.933 -1.031 . . . . 1.16 111.592 178.75 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.535 HG21 ' N ' ' A' ' 131' ' ' ALA . 78.3 t -81.04 -63.01 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-O 121.555 0.693 . . . . 0.27 109.897 172.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 6' ' ' ARG . 55.2 t -54.18 -46.93 67.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.565 -1.198 . . . . 0.33 113.066 -171.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -56.17 -38.99 71.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.66 0.267 . . . . 0.59 110.979 -177.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.714 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 14.7 t80 -71.96 -42.19 66.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.302 -0.408 . . . . 1.61 110.217 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 1.025 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.5 mp -60.53 -41.18 93.92 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 120.499 -0.48 . . . . 0.34 109.952 176.59 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.496 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 23.0 t -61.2 -47.39 86.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 1.05 110.489 178.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -62.4 -30.95 71.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.78 -0.646 . . . . 1.22 110.738 177.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.711 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.4 OUTLIER -81.24 -33.83 32.55 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-N 116.109 -0.496 . . . . 1.41 112.276 -173.815 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.586 ' O ' ' HD3' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -62.23 -27.73 69.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.371 0.605 . . . . 1.35 110.024 174.509 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.4 t -71.39 -16.25 62.4 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.627 -0.715 . . . . 0.94 111.56 -176.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.711 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 19.7 pt20 -79.19 -12.76 59.97 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.356 0.598 . . . . 1.37 111.506 -176.059 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.777 ' NZ ' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -115.51 -20.05 10.37 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 122.197 0.999 . . . . 2.2 109.412 179.415 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.28 28.97 5.59 Favored Glycine 0 C--N 1.306 -1.101 0 CA-C-N 113.696 -1.593 . . . . 0.53 112.931 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -112.77 168.41 9.7 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.724 0.297 . . . . 0.76 111.06 169.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.491 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 5.6 t -110.57 152.31 26.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.341 -0.391 . . . . 0.52 110.743 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.496 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.5 OUTLIER -75.19 -46.7 32.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.972 -0.558 . . . . 3.36 110.279 173.094 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.428 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 13.2 p -65.85 -25.34 67.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.358 -0.383 . . . . 1.37 111.5 -173.366 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.491 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 97.3 mt-30 -63.43 -30.29 71.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.931 0.396 . . . . 1.11 111.051 176.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -121.85 18.51 11.01 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.052 -0.522 . . . . 1.28 111.777 -173.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.428 ' OG ' ' HA ' ' A' ' 25' ' ' SER . 93.3 p -101.02 -178.68 3.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.912 0.863 . . . . 1.81 113.156 -171.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.496 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.3 t70 -165.34 -25.52 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.586 -1.643 . . . . 2.31 108.43 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.899 HG23 ' H ' ' A' ' 31' ' ' GLU . 15.2 m -55.29 -72.12 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 114.1 -1.409 . . . . 0.92 113.014 -174.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.899 ' H ' HG23 ' A' ' 30' ' ' VAL . 34.8 mt-10 -90.17 0.03 57.38 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.759 0.79 . . . . 2.74 108.873 177.313 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 30.8 tt0 -75.29 -52.13 11.58 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.53 -1.214 . . . . 1.45 110.453 -178.181 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -102.56 -38.72 7.41 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.672 -0.695 . . . . 1.87 110.298 -178.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 11.6 mtp180 -93.42 157.98 15.95 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.199 0.524 . . . . 3.39 111.516 177.012 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.1 p -138.04 94.36 2.87 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.069 -0.969 . . . . 2.25 110.007 172.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.709 ' HB3' ' HG3' ' A' ' 3' ' ' GLN . 4.2 mm-40 -60.61 -90.8 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.072 -1.422 . . . . 3.34 111.26 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.675 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -101.22 178.07 1.34 Allowed Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 108.709 -0.849 . . . . 1.92 108.709 177.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.675 ' HD2' ' HB1' ' A' ' 37' ' ' ALA . 34.1 Cg_exo -52.12 151.88 15.83 Favored 'Trans proline' 0 N--CA 1.46 -0.485 0 C-N-CA 121.948 1.766 . . . . 1.87 110.533 171.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -74.13 16.29 0.25 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.267 0.556 . . . . 4.64 111.861 -173.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.412 ' H ' ' C ' ' A' ' 38' ' ' PRO . . . 163.4 61.5 0.02 OUTLIER Glycine 0 N--CA 1.437 -1.274 0 CA-C-N 115.766 -0.652 . . . . 2.15 111.733 176.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.737 HG23 ' OE2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -81.55 -73.73 0.37 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 120.296 -0.561 . . . . 1.12 110.147 179.794 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.737 ' OE2' HG23 ' A' ' 41' ' ' THR . 0.0 OUTLIER -94.18 -32.85 13.54 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.806 0.812 . . . . 2.02 109.814 170.222 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.801 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 5.4 p -56.63 -36.29 69.3 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 113.94 -1.482 . . . . 1.25 113.613 -171.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -46.14 -43.65 15.14 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 123.311 0.382 . . . . 1.91 111.894 -173.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.431 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -83.42 -36.86 23.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.777 0.322 . . . . 0.52 110.482 176.124 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.682 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 79.0 t -54.91 -66.58 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 CA-C-N 115.753 -0.658 . . . . 1.41 111.174 177.042 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.801 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.8 ptpt -58.26 -37.99 76.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.783 -0.644 . . . . 0.67 110.353 -177.416 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.488 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 41.6 mm-40 -63.84 -26.38 68.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.645 -0.707 . . . . 0.99 111.402 175.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.57 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -84.97 -32.03 23.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.437 0.637 . . . . 0.42 109.819 177.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 9.8 mt -67.91 -21.46 65.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.054 -0.976 . . . . 1.33 111.216 -175.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.442 ' HD2' ' OE1' ' A' ' 48' ' ' GLN . 13.0 ptp180 -89.73 -35.31 15.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.574 0.702 . . . . 2.17 109.485 -178.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.743 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.0 mm-40 -67.65 -46.13 73.32 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.789 -1.096 . . . . 1.1 109.396 175.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -71.44 -33.19 69.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.416 -0.811 . . . . 0.53 110.325 176.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.644 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -63.26 -43.63 98.21 Favored Glycine 0 CA--C 1.507 -0.463 0 CA-C-N 115.896 -0.593 . . . . 0.7 111.759 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.58 ' O ' HD22 ' A' ' 59' ' ' LEU . 28.5 t70 -56.54 -34.74 67.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.873 0.368 . . . . 1.04 110.735 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -68.28 -26.85 65.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.288 -0.869 . . . . 2.29 111.72 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -83.25 -39.19 21.2 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.117 -0.492 . . . . 2.29 111.352 176.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.763 ' HA ' ' CE2' ' A' ' 61' ' ' TYR . 43.6 mt-10 -66.97 -53.39 32.08 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 112.892 0.701 . . . . 1.3 112.892 -166.339 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.58 HD22 ' O ' ' A' ' 55' ' ' ASP . 2.3 pt? -51.31 -35.04 35.99 Favored 'General case' 0 C--N 1.32 -0.676 0 O-C-N 123.787 0.68 . . . . 1.54 111.021 -172.404 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 79.8 mtt-85 -64.82 -52.35 57.23 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.213 -0.903 . . . . 2.58 111.621 -178.011 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.763 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 16.4 p90 -91.62 -14.43 30.2 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.082 0.401 . . . . 5.32 112.082 -174.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -60.06 -17.29 38.32 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.029 0.381 . . . . 4.48 112.029 -170.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -61.54 -36.64 81.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.016 0.436 . . . . 4.72 110.72 177.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.619 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -91.43 -24.1 19.82 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.018 0.377 . . . . 1.17 112.018 -179.162 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.535 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 55.0 t80 -40.99 -52.97 3.07 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.621 0.971 . . . . 2.81 113.621 -171.372 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.0 t -69.09 -23.4 64.0 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.904 0.383 . . . . 2.19 111.25 -172.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -89.97 -28.56 19.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.307 -0.406 . . . . 2.72 111.14 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 48.6 mt -70.69 -18.49 62.82 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 112.455 0.539 . . . . 1.56 112.455 -173.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.499 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 2.1 p -55.21 -37.21 66.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.095 0.474 . . . . 0.7 111.189 -178.588 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 28.2 t -61.42 -35.47 77.64 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.599 -0.728 . . . . 1.34 109.983 175.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -80.6 -35.44 34.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.336 -0.847 . . . . 1.42 110.616 -177.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.521 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.4 mm? -65.61 -33.12 75.17 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.784 -0.45 . . . . 1.37 109.784 172.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.477 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 72.8 m80 67.81 42.63 1.91 Allowed 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 108.254 -1.017 . . . . 2.72 108.254 -172.548 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.521 HG12 ' HB2' ' A' ' 72' ' ' LEU . 28.4 mm -53.32 114.95 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 114.039 -1.437 . . . . 0.91 111.114 179.135 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.783 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.76 -168.72 0.21 Allowed Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 107.369 -1.345 . . . . 0.51 107.369 -171.504 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.783 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 71.6 Cg_exo -28.96 165.79 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.507 3.471 . . . . 0.47 115.183 163.057 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.61 -26.54 0.0 OUTLIER Glycine 0 N--CA 1.475 1.291 0 N-CA-C 118.258 2.063 . . . . 0.4 118.258 -171.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.47 ' N ' ' O ' ' A' ' 76' ' ' PRO . 45.4 p -69.29 6.49 0.99 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.493 1.146 . . . . 0.56 112.125 -179.384 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.406 ' HA ' ' OG ' ' A' ' 82' ' ' SER . . . -71.93 -12.48 61.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.286 0.565 . . . . 0.34 110.237 173.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -77.52 -19.75 55.3 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.261 -0.644 . . . . 4.13 109.261 175.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.467 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 30.3 mt-30 -84.39 -20.8 31.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.867 0.841 . . . . 1.03 109.687 173.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.406 ' OG ' ' HA ' ' A' ' 79' ' ' ALA . 3.0 m -74.42 -51.6 14.49 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 114.502 -1.226 . . . . 0.48 109.094 170.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.424 ' HA ' HG23 ' A' ' 86' ' ' VAL . 66.6 t80 -66.27 -17.91 65.03 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.991 -1.004 . . . . 1.18 110.149 175.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.525 ' HA ' HG12 ' A' ' 87' ' ' VAL . 32.1 tt0 -59.47 -51.31 70.4 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-O 121.624 0.726 . . . . 0.8 109.869 178.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.481 ' H ' ' HG2' ' A' ' 85' ' ' GLN . 55.4 mm-40 -48.22 -32.64 7.42 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 113.456 -1.702 . . . . 1.62 110.706 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.607 ' HA ' ' HG3' ' A' ' 89' ' ' GLU . 0.8 OUTLIER -89.06 -51.36 12.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 113.961 -1.472 . . . . 1.3 111.25 -175.413 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.525 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.9 p -60.96 -22.17 26.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-O 121.824 0.821 . . . . 0.85 109.372 -177.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.456 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 5.1 m-80 -77.45 -36.91 52.52 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 113.982 -1.463 . . . . 0.91 111.858 175.382 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.973 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.0 OUTLIER -83.91 -17.34 41.08 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 121.951 0.882 . . . . 2.87 110.284 179.88 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.686 ' HG ' HH11 ' A' ' 99' ' ' ARG . 0.0 OUTLIER -75.43 -50.74 14.9 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 114.98 -1.009 . . . . 1.28 110.525 -179.483 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.456 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 4.4 p90 -88.36 -23.71 23.31 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.204 0.816 . . . . 2.3 113.204 -166.632 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.685 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -58.19 -39.55 79.24 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.454 0.909 . . . . 5.06 113.454 -165.23 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -110.08 22.94 14.97 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 115.113 1.523 . . . . 3.12 115.113 -167.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 134.41 73.63 0.08 OUTLIER Glycine 0 C--N 1.318 -0.462 0 C-N-CA 117.457 -2.306 . . . . 2.31 115.303 -176.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.641 HG22 HH21 ' A' ' 99' ' ' ARG . 89.0 t -71.72 102.69 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.79 0.805 . . . . 1.06 111.56 178.21 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -112.01 -174.87 2.55 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.784 -1.098 . . . . 2.12 109.531 -179.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.605 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 18.7 m-90 -59.8 -60.64 3.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.111 0.481 . . . . 3.34 110.643 178.461 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.553 ' O ' ' HB ' ' A' ' 101' ' ' VAL . . . -66.66 -25.84 72.9 Favored Glycine 0 C--N 1.33 0.211 0 CA-C-N 115.647 -0.706 . . . . 0.69 112.544 -176.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.686 HH11 ' HG ' ' A' ' 90' ' ' LEU . 1.1 tmm_? -64.67 -39.87 94.43 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.475 -0.565 . . . . 4.24 109.475 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.606 HG22 ' CE2' ' A' ' 104' ' ' PHE . 82.9 mt -69.86 -33.14 54.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.266 -0.425 . . . . 0.44 110.406 178.395 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.553 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 91.6 t -51.46 -57.14 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-N 116.002 -0.545 . . . . 1.35 110.44 170.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -47.76 -41.84 24.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.012 -0.994 . . . . 0.44 111.52 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.468 ' HB3' ' O ' ' A' ' 100' ' ' ILE . 27.5 t80 -60.29 -43.1 96.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.999 -1.001 . . . . 1.49 110.934 178.214 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.606 ' CE2' HG22 ' A' ' 100' ' ' ILE . 37.4 m-85 -68.41 -37.64 80.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.325 . . . . 3.29 110.565 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.714 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 16.2 m -61.82 -54.88 36.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.861 -0.609 . . . . 1.19 111.071 -176.616 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -72.56 -31.04 64.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.823 0.344 . . . . 2.89 110.281 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.655 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -66.79 -43.73 90.98 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.87 -0.681 . . . . 0.3 111.81 177.361 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 1.025 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.85 -29.02 73.39 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.686 -0.769 . . . . 0.23 111.189 175.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.535 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -72.7 -34.14 66.93 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.402 -0.399 . . . . 0.31 110.244 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.523 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.3 OUTLIER -65.57 -34.64 78.72 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.933 0.873 . . . . 1.12 109.996 -179.072 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.68 ' O ' HG23 ' A' ' 115' ' ' VAL . 43.0 t -51.89 -50.04 61.83 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.268 -1.333 . . . . 0.26 109.369 171.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.777 HG13 ' NZ ' ' A' ' 20' ' ' LYS . 97.1 t -64.9 -36.24 77.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 116.268 -0.424 . . . . 0.35 110.527 176.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.523 ' OE2' ' HA ' ' A' ' 110' ' ' LEU . 37.5 mt-10 -54.65 -37.63 65.93 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.073 0.463 . . . . 2.51 110.341 175.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 21.1 m -78.85 -38.79 37.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.983 -0.553 . . . . 0.28 109.995 -178.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.68 HG23 ' O ' ' A' ' 111' ' ' CYS . 93.6 t -68.53 -33.26 59.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.716 0.77 . . . . 1.23 109.197 -177.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -55.67 -50.13 71.08 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 113.757 -1.565 . . . . 0.6 111.575 -178.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -87.5 13.48 10.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.932 -0.576 . . . . 1.62 110.211 -178.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 63.88 52.02 2.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.821 0.819 . . . . 1.88 111.502 -178.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.59 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 25.9 mtm -130.64 48.37 2.42 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.751 -1.203 . . . . 0.31 107.751 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.498 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 0.0 OUTLIER -64.17 -8.26 11.75 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 114.756 -1.111 . . . . 1.15 112.4 -173.608 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.581 HG23 HD22 ' A' ' 122' ' ' LEU . 28.2 m -64.62 -19.66 25.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.808 0.337 . . . . 0.46 111.575 176.16 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.617 HD13 ' HD3' ' A' ' 125' ' ' ARG . 3.1 mm? -79.81 -24.29 41.5 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.468 -0.333 . . . . 0.26 110.146 178.588 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.662 HG13 ' SG ' ' A' ' 111' ' ' CYS . 56.7 t -46.93 -56.72 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 O-C-N 123.658 0.599 . . . . 0.25 111.849 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.415 ' OG ' HG13 ' A' ' 30' ' ' VAL . 6.6 t -71.1 -29.84 65.79 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.712 -0.395 . . . . 1.35 110.275 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.617 ' HD3' HD13 ' A' ' 122' ' ' LEU . 17.2 mtp180 -65.1 -58.51 5.85 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 116.283 -0.417 . . . . 2.67 110.857 178.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 122' ' ' LEU . 79.2 mt -49.93 -49.9 20.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.58 -0.737 . . . . 0.23 110.565 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.666 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -59.04 -36.49 75.11 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.727 0.299 . . . . 0.29 111.528 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.26 -56.69 11.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.504 0.668 . . . . 0.28 110.936 177.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.486 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 94.3 m95 -64.47 -35.0 79.53 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.809 -1.087 . . . . 3.91 111.182 -176.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.655 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 1.2 mmm -63.87 -50.5 68.58 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.073 0.463 . . . . 1.08 110.824 177.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.535 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -63.48 -34.81 78.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.859 -0.61 . . . . 0.25 110.472 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 69.4 m -64.46 -48.12 76.46 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.165 -0.47 . . . . 0.4 110.955 177.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -56.95 -39.56 74.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.814 0.34 . . . . 3.13 110.094 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.624 HD13 ' HB2' ' A' ' 5' ' ' ASN . 5.6 tt -60.93 -52.08 66.55 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.702 -0.851 . . . . 0.95 108.702 173.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -50.58 -49.09 57.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.742 -0.663 . . . . 0.46 112.023 179.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.96 -53.43 6.75 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.028 0.442 . . . . 0.59 111.485 -174.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.7 -51.07 5.42 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 112.953 0.723 . . . . 1.45 112.953 -169.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 40.6 mt -86.68 -31.57 20.97 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.908 0.707 . . . . 1.2 112.908 -163.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 31.1 tt0 -51.76 -51.95 65.48 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 112.247 0.462 . . . . 0.75 112.247 -173.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.583 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 32.9 Cg_exo -59.48 -46.68 19.79 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 121.621 1.547 . . . . 0.56 111.643 176.343 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' TRP . . . . . 0.52 ' CE2' ' HB ' ' A' ' 95' ' ' VAL . 0.5 OUTLIER -53.32 -53.32 52.7 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.658 -0.701 . . . . 1.2 110.31 177.787 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.554 HG22 ' HA2' ' A' ' 147' ' ' GLY . 45.5 mt -47.09 -52.79 4.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.446 -0.797 . . . . 0.32 111.662 174.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.626 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.3 mm-40 -59.83 -32.01 70.27 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.129 -0.487 . . . . 0.57 111.678 -178.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 13.4 mm-40 -64.5 -21.29 66.63 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.482 0.658 . . . . 0.78 110.767 177.576 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -112.68 6.37 18.2 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.212 -0.904 . . . . 0.93 110.786 -173.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 118.05 -46.69 1.11 Allowed Glycine 0 N--CA 1.442 -0.928 0 CA-C-N 115.501 -0.772 . . . . 0.56 113.099 173.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' GLY . . . . . 0.554 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 132.74 -171.68 21.58 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.322 -0.942 . . . . 0.49 112.476 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.446 ' NE1' HD13 ' A' ' 142' ' ' ILE . 19.7 m-90 -80.02 -45.92 17.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.96 0.409 . . . . 3.57 110.427 -178.057 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.444 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 18.9 t70 -56.86 -37.88 71.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.412 -0.813 . . . . 1.96 110.018 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.653 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 90.6 m -59.37 -36.65 76.15 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.346 -0.843 . . . . 0.67 111.384 178.468 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.605 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 62.6 t80 -63.63 -35.74 81.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.921 0.391 . . . . 3.0 110.493 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.603 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 0.7 OUTLIER -74.51 -25.3 19.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.463 0.649 . . . . 1.15 109.67 178.197 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 7.0 mm-40 -70.1 -26.54 64.03 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.736 -0.665 . . . . 1.67 109.383 173.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.653 ' HG ' ' O ' ' A' ' 150' ' ' THR . 12.1 mt -83.24 -58.63 2.76 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.545 -0.752 . . . . 1.3 110.338 177.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -114.51 -42.34 3.31 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.597 -0.274 . . . . 4.24 110.495 -175.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.57 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . 47.54 -156.01 0.94 Allowed Glycine 0 CA--C 1.506 -0.474 0 O-C-N 123.89 0.744 . . . . 1.1 114.037 -177.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.743 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 26.3 t-20 -104.41 109.02 20.72 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 114.844 -0.678 . . . . 1.29 110.113 -176.061 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.734 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 88.5 m-20 -72.53 -22.41 61.03 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.534 -0.303 . . . . 2.99 111.717 -172.214 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -56.52 -43.57 79.94 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.005 0.431 . . . . 2.52 110.135 173.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' A' ' 163' ' ' SER . . . -89.97 -40.0 12.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.133 -0.485 . . . . 2.87 111.062 177.184 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.734 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -57.36 -54.09 50.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.194 -0.457 . . . . 3.2 111.778 -177.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -66.4 -18.56 65.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.713 0.292 . . . . 3.72 111.342 -178.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.464 ' HB3' ' O ' ' A' ' 160' ' ' ALA . 47.7 t -68.67 -30.41 69.08 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.626 -0.509 . . . . 4.18 109.626 174.135 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 164' ' ' ARG . . . . . 0.521 ' O ' ' HG3' ' A' ' 168' ' ' GLU . 12.2 mpt_? -88.14 -25.21 23.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.26 0.552 . . . . 5.82 109.871 176.03 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -61.95 -36.35 81.16 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.423 -0.808 . . . . 4.77 110.127 177.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -63.73 -33.46 87.29 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.643 -0.708 . . . . 5.1 112.921 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -89.15 -19.45 25.48 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.862 0.331 . . . . 5.72 111.162 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.521 ' HG3' ' O ' ' A' ' 164' ' ' ARG . 41.4 mt-10 -82.6 7.83 13.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.689 0.28 . . . . 5.88 110.581 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.515 ' HG3' HD22 ' A' ' 170' ' ' LEU . 21.5 tpp180 -49.91 -52.84 30.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.817 -0.629 . . . . 7.34 110.787 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.515 HD22 ' HG3' ' A' ' 169' ' ' ARG . 3.6 mm? -121.86 -27.36 4.66 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.16 -0.473 . . . . 6.97 110.325 177.205 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -77.59 87.66 3.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.242 0.544 . . . . 6.97 110.305 178.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -164.81 165.55 20.49 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.588 -0.733 . . . . 9.35 109.321 178.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -73.05 127.39 32.43 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.913 0.387 . . . . 11.4 110.421 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 32.7 p80 -128.44 170.08 13.55 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.065 -0.716 . . . . 11.52 109.065 173.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 78.6 m-70 -78.24 142.52 37.8 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.887 0.375 . . . . 14.48 110.253 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -130.51 145.93 51.95 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.638 -0.875 . . . . 15.37 108.638 177.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 67.7 86.14 0.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.473 0.654 . . . . 16.02 109.418 -174.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -168.92 149.65 4.43 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.06 -0.973 . . . . 17.99 108.823 -176.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -75.02 113.76 12.71 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.237 0.541 . . . . 19.19 109.892 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -136.36 101.81 4.78 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.568 -0.742 . . . . 22.26 109.281 178.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -71.58 -37.45 71.03 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.649 -0.705 . . . . 22.51 111.68 -172.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 48.6 t-80 75.09 -37.2 0.34 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.4 0.68 . . . . 24.89 111.247 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -145.76 134.84 22.71 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.426 -0.583 . . . . 25.58 109.426 177.081 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 58.9 m80 -70.53 -45.26 65.88 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.803 0.335 . . . . 27.37 110.886 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 9.8 p80 . . . . . 0 C--O 1.244 0.799 0 CA-C-O 118.908 -0.568 . . . . 29.06 110.416 178.679 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.074 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -94.39 69.12 1.3 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.617 -0.801 . . . . 2.97 111.638 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.582 ' HA ' ' C2 ' ' B' 1100 ' ' 33B . 3.7 m -107.16 -156.42 0.58 Allowed 'General case' 0 C--N 1.324 -0.542 0 O-C-N 122.545 -0.385 . . . . 1.94 110.667 -175.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.711 ' HA ' ' CD2' ' B' 1008 ' ' LEU . 4.9 m 38.94 -98.06 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 124.605 1.191 . . . . 1.63 112.873 176.654 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B 1005 ' ' GLY . . . . . 0.425 ' H ' HG23 ' B' 1004 ' ' VAL . . . -18.37 -45.47 0.01 OUTLIER Glycine 0 CA--C 1.537 1.464 0 N-CA-C 114.63 0.612 . . . . 1.2 114.63 159.527 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B 1006 ' ' ARG . . . . . 0.418 ' HA ' ' HD3' ' B' 1006 ' ' ARG . 31.8 mmt180 -105.71 -26.92 11.6 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.371 0.878 . . . . 2.88 113.371 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -78.68 -61.36 2.04 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.282 0.845 . . . . 1.31 113.282 -165.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.738 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 1.3 mm? -65.31 -44.65 87.2 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.734 -0.839 . . . . 1.33 108.734 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B 1009 ' ' ALA . . . . . 0.973 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -37.25 -52.03 1.05 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.512 -1.222 . . . . 0.88 110.855 169.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.773 ' HB1' ' N11' ' B' 1100 ' ' 33B . . . -76.75 -46.63 24.51 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 113.807 -1.542 . . . . 1.03 111.918 -174.628 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.587 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 30.3 m-85 -68.67 -24.91 64.58 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.36 -0.382 . . . . 1.67 111.042 -178.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -72.72 -14.24 78.07 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.966 -0.561 . . . . 0.78 112.464 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 13.3 t70 -64.78 -20.26 66.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.345 0.593 . . . . 1.9 110.455 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 15.5 m -94.44 35.74 1.19 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.831 -0.622 . . . . 1.44 111.889 -177.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.412 HG12 ' H ' ' B' 1015 ' ' ILE . 5.0 pt -77.77 69.54 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.998 0.428 . . . . 2.91 111.745 177.245 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 10.9 p30 -126.18 175.66 7.62 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 110.171 -0.307 . . . . 4.29 110.171 177.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -90.7 92.9 9.02 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.21 -0.45 . . . . 8.17 110.098 178.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.533 0 CA-C-N 116.418 -0.356 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.773 ' N11' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.1 0 CA-C-O 120.948 0.404 . . . . 6.21 110.447 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.9 m -69.42 114.67 7.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.255 -0.429 . . . . 1.87 110.883 -177.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -63.99 -19.96 65.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.088 0.47 . . . . 2.42 110.468 175.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 p -63.4 -23.5 67.43 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.623 -0.717 . . . . 1.25 112.028 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.909 ' HA ' HD22 ' A' ' 8' ' ' LEU . 73.1 m-20 -62.62 -28.18 69.73 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.308 0.575 . . . . 1.78 109.806 176.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.517 ' O ' HG23 ' A' ' 10' ' ' VAL . 7.0 tpp180 -60.64 -48.6 81.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.226 -0.897 . . . . 1.4 110.22 177.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -56.76 -51.45 68.86 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.392 -0.822 . . . . 0.68 111.209 -178.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.909 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.0 OUTLIER -47.62 -42.68 24.76 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.536 -0.756 . . . . 1.16 110.912 177.531 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.488 HG11 ' HA ' ' A' ' 127' ' ' ALA . 73.1 t -68.88 -63.7 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.46 -0.791 . . . . 0.27 110.195 176.295 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 6' ' ' ARG . 97.7 t -49.31 -53.68 8.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.416 -0.811 . . . . 0.33 112.979 -176.277 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -57.81 -34.09 69.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.007 0.432 . . . . 0.59 110.598 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.753 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.7 t80 -75.79 -46.52 30.25 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.111 -0.495 . . . . 1.61 110.671 -179.345 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 1.058 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.5 mp -59.87 -42.72 94.33 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 120.787 -0.365 . . . . 0.34 110.311 178.375 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.413 ' HA ' HD12 ' A' ' 17' ' ' LEU . 37.8 t -60.34 -38.89 85.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.951 -0.568 . . . . 1.05 110.47 178.225 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -71.33 -18.07 62.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.751 -0.659 . . . . 1.22 110.75 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.734 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 10.1 mmpt? -84.86 -46.36 11.4 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 121.368 0.604 . . . . 1.41 110.252 -179.16 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.757 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 14.6 mt -55.95 -26.92 50.11 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.125 -0.943 . . . . 1.35 111.276 177.105 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.6 t -58.55 -35.11 71.81 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.175 -0.921 . . . . 0.94 112.522 176.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.734 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 27.8 pt20 -80.43 -7.94 59.34 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.989 0.737 . . . . 1.37 112.989 -170.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 1.018 ' HZ2' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -111.93 -20.14 12.12 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 122.164 0.983 . . . . 2.2 109.238 178.545 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.09 28.1 6.29 Favored Glycine 0 C--N 1.306 -1.134 0 CA-C-N 113.652 -1.613 . . . . 0.53 112.741 174.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.545 ' HD1' ' HE3' ' A' ' 20' ' ' LYS . 70.8 m-85 -110.17 166.25 11.11 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.716 0.293 . . . . 0.76 110.83 172.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.514 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 4.0 t -110.62 154.98 23.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.341 -0.391 . . . . 0.52 110.554 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.571 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 68.0 t-105 -72.64 -54.5 8.88 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.101 -0.5 . . . . 3.36 110.252 174.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.4 t -62.38 -27.52 69.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.699 -0.682 . . . . 1.37 111.776 -173.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.514 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 95.3 mt-30 -59.26 -26.6 65.06 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 111.898 0.333 . . . . 1.11 111.898 178.652 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -119.94 -10.73 9.42 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.086 0.402 . . . . 1.28 112.086 -173.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.548 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 49.3 m -101.89 179.53 4.3 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 113.627 0.973 . . . . 1.81 113.627 -169.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.437 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 0.8 OUTLIER -156.08 -14.26 0.1 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.376 -1.284 . . . . 2.31 110.015 -179.015 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.905 HG23 ' H ' ' A' ' 31' ' ' GLU . 12.3 m -51.95 -71.56 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.479 -1.237 . . . . 0.92 112.76 -169.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.905 ' H ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -99.9 1.22 42.61 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-O 121.54 0.686 . . . . 2.74 109.672 177.844 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.437 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.5 tt0 -67.36 -56.03 11.36 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.697 -1.138 . . . . 1.45 111.157 -178.521 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -98.33 -51.67 3.9 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.9 -0.591 . . . . 1.87 111.518 -172.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 28.9 ptt-85 -92.77 160.99 14.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.002 0.43 . . . . 3.39 111.223 -176.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.3 p -113.07 114.1 26.37 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.507 0.67 . . . . 2.25 111.252 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -122.22 -66.67 1.01 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.161 -0.927 . . . . 3.34 109.832 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -97.64 148.83 35.01 Favored Pre-proline 0 C--N 1.318 -0.776 0 CA-C-N 115.24 -0.891 . . . . 1.92 110.474 176.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.731 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 35.2 Cg_exo -62.0 -176.83 0.23 Allowed 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 123.13 2.553 . . . . 1.87 112.258 175.118 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -81.43 -4.76 56.75 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.483 0.658 . . . . 4.64 110.449 177.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 154.5 69.63 0.01 OUTLIER Glycine 0 N--CA 1.441 -0.971 0 CA-C-N 115.338 -0.846 . . . . 2.15 111.168 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.798 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.6 OUTLIER -69.61 -76.43 0.1 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.89 0.376 . . . . 1.12 110.46 -176.63 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.798 ' H ' HG23 ' A' ' 41' ' ' THR . 15.4 pt-20 -93.53 -27.82 16.42 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-O 123.176 1.465 . . . . 2.02 107.908 166.428 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.503 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.1 OUTLIER -66.83 -20.92 66.03 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 111.676 -2.511 . . . . 1.25 113.954 -167.577 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 35.5 tt0 -54.89 -59.84 4.18 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.933 -0.307 . . . . 1.91 111.012 -179.201 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.465 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -64.58 -36.35 83.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.223 0.535 . . . . 0.52 110.034 179.195 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.566 ' HA ' HG12 ' A' ' 152' ' ' VAL . 99.4 t -59.5 -60.74 2.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 114.917 -1.038 . . . . 1.41 111.14 178.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.485 ' HB3' HD12 ' A' ' 8' ' ' LEU . 11.2 ptpt -62.42 -35.13 78.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.624 0.726 . . . . 0.67 109.255 -176.862 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.591 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 41.4 mm-40 -65.95 -32.31 73.73 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.941 -1.027 . . . . 0.99 110.826 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.695 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -74.5 -43.88 53.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.13 0.49 . . . . 0.42 110.624 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.474 ' O ' ' HE2' ' A' ' 12' ' ' PHE . 8.0 mp -63.25 -26.54 68.83 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.429 -0.805 . . . . 1.33 112.88 -174.367 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.522 ' HD3' ' OE1' ' A' ' 48' ' ' GLN . 10.4 ptm180 -78.51 -32.41 48.09 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.156 -1.053 . . . . 2.17 108.156 -175.422 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 3.7 mm-40 -80.41 -44.19 19.75 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 113.565 -1.652 . . . . 1.1 109.907 -179.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.29 -41.08 98.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.486 -0.779 . . . . 0.53 110.169 175.129 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.729 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.16 -42.23 98.49 Favored Glycine 0 C--O 1.22 -0.759 0 CA-C-N 115.558 -0.746 . . . . 0.7 112.001 177.568 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.59 ' O ' HD22 ' A' ' 59' ' ' LEU . 29.8 t70 -53.46 -37.78 62.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.948 0.404 . . . . 1.04 111.296 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -71.93 -24.92 61.71 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.729 -0.669 . . . . 2.29 111.863 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -84.01 -44.62 13.96 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 112.103 0.408 . . . . 2.29 112.103 174.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.729 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.3 mt-10 -66.02 -46.27 78.48 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.111 0.782 . . . . 1.3 113.111 -164.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.59 HD22 ' O ' ' A' ' 55' ' ' ASP . 2.5 pt? -53.46 -31.22 44.62 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.014 -0.539 . . . . 1.54 111.347 -173.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 67.2 mtt-85 -64.93 -53.71 42.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.549 -0.75 . . . . 2.58 111.741 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.719 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 15.3 p90 -90.76 -3.8 57.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.595 -0.275 . . . . 5.32 111.119 -176.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.4 ttt180 -53.59 -34.87 59.93 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.469 0.544 . . . . 4.48 112.469 -172.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -64.77 -33.88 77.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.992 0.425 . . . . 4.72 110.761 177.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.582 ' HB1' HD13 ' A' ' 68' ' ' LEU . . . -78.37 -28.91 47.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.891 -0.595 . . . . 1.17 110.577 -178.511 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.573 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 52.7 t80 -44.3 -46.91 9.42 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.543 0.572 . . . . 2.81 112.543 -176.415 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 36.7 t -62.76 -44.68 95.55 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.894 0.378 . . . . 2.19 110.744 -177.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.75 -29.12 40.43 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.104 -0.498 . . . . 2.72 111.549 -176.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.727 ' HA ' ' HG3' ' A' ' 71' ' ' GLN . 4.1 mp -61.6 -24.37 66.64 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.677 0.621 . . . . 1.56 112.677 -175.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.475 HG22 HG13 ' A' ' 74' ' ' ILE . 21.2 p -57.73 -29.13 64.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.171 0.51 . . . . 0.7 110.719 178.479 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.5 t -76.8 -38.87 53.17 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.566 -0.743 . . . . 1.34 109.768 176.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.727 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 24.8 mt-30 -65.63 -47.17 76.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.32 -0.854 . . . . 1.42 110.161 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.602 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.2 mt -74.8 -31.4 61.72 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.753 -0.658 . . . . 1.37 110.545 178.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.468 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 92.8 m-70 71.86 54.64 0.19 Allowed 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.563 0.697 . . . . 2.72 109.276 -176.436 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.478 HG21 ' HB3' ' A' ' 113' ' ' GLU . 15.2 mm -58.58 118.47 2.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 114.165 -1.379 . . . . 0.91 110.666 -179.732 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.758 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -156.39 -170.41 0.24 Allowed Pre-proline 0 CA--C 1.546 0.827 0 N-CA-C 107.98 -1.118 . . . . 0.51 107.98 -169.214 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.758 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 38.4 Cg_exo -29.47 166.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.278 0 C-N-CA 124.814 3.676 . . . . 0.47 115.091 163.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -33.24 -24.08 0.01 OUTLIER Glycine 0 N--CA 1.471 1.0 0 N-CA-C 117.259 1.664 . . . . 0.4 117.259 -174.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.453 ' N ' ' O ' ' A' ' 76' ' ' PRO . 17.2 p -71.96 6.3 2.17 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 117.994 0.897 . . . . 0.56 112.216 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.57 -12.64 61.56 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.165 0.507 . . . . 0.34 110.19 174.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.453 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 1.8 p90 -76.0 -15.13 60.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.013 -0.539 . . . . 4.13 109.841 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.472 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 36.3 mt-30 -83.38 -26.31 30.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.451 -0.795 . . . . 1.03 109.793 173.128 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.544 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.2 m -74.48 -50.12 19.56 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.041 -0.981 . . . . 0.48 109.392 172.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -65.54 -18.29 65.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.991 -1.004 . . . . 1.18 110.06 175.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.574 ' HA ' HG12 ' A' ' 87' ' ' VAL . 37.9 tt0 -62.84 -49.02 76.54 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.258 -0.883 . . . . 0.8 110.57 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.409 ' O ' ' HG2' ' A' ' 89' ' ' GLU . 73.5 mt-30 -48.1 -36.43 13.2 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.716 -1.129 . . . . 1.62 110.125 177.594 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.79 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.0 OUTLIER -81.37 -54.58 9.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 114.452 -1.249 . . . . 1.3 111.026 -176.108 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.574 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.6 p -59.33 -23.45 25.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 122.038 0.923 . . . . 0.85 109.396 -177.105 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.7 m-80 -71.31 -58.46 3.51 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 113.945 -1.48 . . . . 0.91 110.894 172.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 1.028 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.0 OUTLIER -62.26 -38.8 90.69 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-O 121.967 0.889 . . . . 2.87 109.358 -174.396 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' A' ' 86' ' ' VAL . 1.7 tp -56.12 -30.55 62.25 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 113.194 -1.821 . . . . 1.28 110.912 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.574 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 71.6 t80 -94.35 -33.38 13.2 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.488 -0.324 . . . . 2.3 111.839 -168.63 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.91 -45.99 47.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 122.119 0.961 . . . . 5.06 110.213 -175.286 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -95.82 20.63 9.61 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 113.803 -1.544 . . . . 3.12 112.568 -159.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.473 ' O ' ' HG2' ' A' ' 99' ' ' ARG . . . 130.16 68.56 0.11 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 118.141 -1.981 . . . . 2.31 115.757 174.114 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.66 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 61.2 t -73.04 98.71 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 118.593 1.196 . . . . 1.06 110.23 173.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.598 ' ND2' ' HB3' ' A' ' 99' ' ' ARG . 3.3 p30 -111.98 -174.46 2.47 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.537 -1.21 . . . . 2.12 109.24 175.271 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.643 ' HA ' ' CE2' ' A' ' 151' ' ' PHE . 16.1 m-90 -61.68 -45.62 93.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.979 -0.555 . . . . 3.34 110.856 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.44 ' C ' HG12 ' B' 1015 ' ' ILE . . . -77.43 -37.0 32.46 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.905 -0.589 . . . . 0.69 113.456 -174.204 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.67 ' NH2' HD11 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -64.83 -29.14 70.09 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 122.433 -0.451 . . . . 4.24 110.524 -177.168 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.563 HG22 ' HE1' ' A' ' 104' ' ' PHE . 45.4 mt -68.58 -36.91 76.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 C-N-CA 120.231 -0.587 . . . . 0.44 110.314 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.42 HG13 ' O ' ' A' ' 98' ' ' GLY . 0.6 OUTLIER -59.46 -31.46 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 109.562 -0.532 . . . . 1.35 109.562 175.946 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 99' ' ' ARG . . . -65.74 -35.36 80.5 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.837 -0.62 . . . . 0.44 111.06 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.464 ' HB3' ' O ' ' A' ' 100' ' ' ILE . 17.4 t80 -60.95 -32.78 72.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.114 -0.948 . . . . 1.49 109.95 177.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.721 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 89.1 m-85 -80.27 -35.94 35.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.945 -0.57 . . . . 3.29 110.4 175.091 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.753 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 20.0 m -61.44 -53.58 54.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.082 -0.508 . . . . 1.19 110.658 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.553 ' HZ ' HD11 ' A' ' 72' ' ' LEU . 32.2 t80 -73.46 -33.61 64.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.06 -0.518 . . . . 2.89 110.392 -178.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.474 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -67.93 -44.83 77.29 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.974 -0.631 . . . . 0.3 111.835 178.476 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 1.058 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.22 -31.67 81.37 Favored Glycine 0 N--CA 1.442 -0.914 0 N-CA-C 111.097 -0.801 . . . . 0.23 111.097 175.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.573 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -68.52 -34.77 76.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.304 -0.448 . . . . 0.31 109.887 176.514 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.455 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.2 OUTLIER -64.2 -35.63 81.44 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.909 0.861 . . . . 1.12 110.169 -178.52 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.721 ' SG ' HD21 ' A' ' 17' ' ' LEU . 41.4 t -52.55 -49.16 65.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.51 -1.223 . . . . 0.26 109.478 172.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 1.018 HG13 ' HZ2' ' A' ' 20' ' ' LYS . 94.5 t -64.59 -37.15 79.32 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 CA-C-N 116.272 -0.422 . . . . 0.35 110.557 175.529 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.478 ' HB3' HG21 ' A' ' 74' ' ' ILE . 46.5 mt-10 -56.44 -34.85 67.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.96 0.41 . . . . 2.51 110.965 176.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.419 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 26.6 m -79.34 -36.75 38.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.366 0.603 . . . . 0.28 109.715 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.679 HG23 ' O ' ' A' ' 111' ' ' CYS . 98.1 t -69.34 -32.19 52.46 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.993 0.902 . . . . 1.23 109.427 -178.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -56.83 -50.05 73.56 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.596 -1.638 . . . . 0.6 111.302 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 35.9 mmtt -85.87 13.8 6.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.795 -0.639 . . . . 1.62 110.608 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 62.16 48.45 4.97 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.626 0.727 . . . . 1.88 110.497 -178.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 31.4 mtm -126.67 44.09 2.96 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.909 -1.145 . . . . 0.31 107.909 -178.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.629 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 12.4 mp0 -61.75 -6.99 2.99 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.927 -1.033 . . . . 1.15 113.31 -171.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.511 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 34.2 m -65.55 -25.32 36.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 120.771 0.32 . . . . 0.46 111.029 176.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.626 HD13 ' HD2' ' A' ' 125' ' ' ARG . 2.9 mm? -73.89 -25.3 59.95 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 116.563 -0.289 . . . . 0.26 110.556 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.714 HG13 ' SG ' ' A' ' 111' ' ' CYS . 53.2 t -44.13 -53.12 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 O-C-N 123.63 0.581 . . . . 0.25 112.211 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.548 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 6.4 t -78.32 -22.2 48.48 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.097 0.475 . . . . 1.35 110.687 -177.424 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.626 ' HD2' HD13 ' A' ' 122' ' ' LEU . 75.1 mtt180 -79.33 -44.87 20.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.093 -0.503 . . . . 2.67 110.897 -177.81 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.679 ' HA ' ' CE3' ' A' ' 129' ' ' TRP . 85.6 mt -56.15 -47.46 80.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.838 -0.619 . . . . 0.23 110.781 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.571 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -59.2 -35.95 74.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.818 0.342 . . . . 0.29 111.024 178.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -58.1 -58.72 7.17 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.58 0.705 . . . . 0.28 110.383 175.769 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.679 ' CE3' ' HA ' ' A' ' 126' ' ' ILE . 16.6 m0 -56.12 -48.46 76.16 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.22 -1.354 . . . . 3.91 110.32 -178.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.541 ' SD ' HG22 ' A' ' 126' ' ' ILE . 91.3 mtp -59.06 -55.02 40.49 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.658 -0.701 . . . . 1.08 111.787 -176.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.22 -38.66 87.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.137 -0.483 . . . . 0.25 111.42 -177.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 47.8 m -65.66 -47.21 76.28 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.73 -0.388 . . . . 0.4 110.7 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.627 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 5.5 m-85 -56.36 -36.06 68.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.3 -0.409 . . . . 3.13 110.529 177.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.847 HD13 ' HB3' ' A' ' 5' ' ' ASN . 4.2 tt -62.28 -58.38 7.92 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.786 -0.82 . . . . 0.95 108.786 170.522 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -48.38 -45.66 36.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.338 -0.846 . . . . 0.46 112.842 -176.302 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -88.96 -45.81 9.38 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.056 0.391 . . . . 0.59 112.056 -175.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' HIS . . . . . 0.627 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 31.0 m-70 -91.25 -48.98 6.62 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.414 0.524 . . . . 1.45 112.414 -170.15 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.764 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -88.52 -44.24 10.82 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 113.819 1.044 . . . . 1.2 113.819 -168.603 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.62 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 34.8 tt0 -43.44 -53.15 12.09 Favored Pre-proline 0 C--N 1.323 -0.566 0 O-C-N 123.831 0.707 . . . . 0.75 112.8 -174.703 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.654 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 10.8 Cg_endo -54.37 -49.44 16.92 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 121.857 1.705 . . . . 0.56 111.574 177.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 5.0 t-105 -55.99 -52.99 62.22 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.556 -0.747 . . . . 1.2 110.341 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.57 HD12 ' HA ' ' A' ' 139' ' ' GLU . 43.6 mt -46.55 -52.29 3.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.804 -0.634 . . . . 0.32 111.812 176.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.62 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.8 mm-40 -60.25 -32.09 70.82 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.766 -0.652 . . . . 0.57 111.782 -179.267 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.654 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.6 mm-40 -65.44 -21.43 66.65 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 121.659 0.742 . . . . 0.78 110.464 177.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -107.87 9.57 28.77 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.019 -0.991 . . . . 0.93 110.016 -174.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 121.46 -29.37 5.7 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.902 -1.045 . . . . 0.56 113.38 171.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 108.64 166.11 20.89 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.649 -0.786 . . . . 0.49 111.227 -175.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.786 ' HZ2' HD11 ' A' ' 134' ' ' LEU . 16.9 m95 -57.16 -40.39 77.15 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.82 0.674 . . . . 3.57 112.82 -174.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.534 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 9.9 m-20 -55.35 -41.61 72.76 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.303 -0.258 . . . . 1.96 110.303 177.693 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.606 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 23.4 m -56.58 -38.55 72.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.234 -0.439 . . . . 0.67 111.508 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.643 ' CE2' ' HA ' ' A' ' 97' ' ' TRP . 1.2 m-85 -61.29 -36.77 81.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.543 0.687 . . . . 3.0 109.44 -178.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.566 HG12 ' HA ' ' A' ' 46' ' ' VAL . 0.7 OUTLIER -80.32 -25.41 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 115.382 -0.827 . . . . 1.15 110.042 178.115 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 6.6 mm-40 -64.56 -29.73 70.75 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.135 0.493 . . . . 1.67 109.902 173.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 150' ' ' THR . 9.5 mt -82.96 -56.44 3.81 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.633 -0.712 . . . . 1.3 110.164 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 155' ' ' TYR . . . . . 0.429 ' HE2' ' HB2' ' A' ' 52' ' ' GLU . 62.5 t80 -113.48 -44.93 3.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.296 -0.411 . . . . 4.24 110.752 -176.362 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.695 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . 43.36 -157.15 0.12 Allowed Glycine 0 CA--C 1.502 -0.746 0 CA-C-O 121.769 0.65 . . . . 1.1 113.829 -177.179 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.591 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 27.4 t-20 -112.02 108.2 17.43 Favored 'General case' 0 N--CA 1.426 -1.636 0 CA-C-N 114.776 -0.712 . . . . 1.29 109.745 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.694 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 8.9 m120 -74.72 -25.11 58.9 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.081 -0.508 . . . . 2.99 111.421 -175.399 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -56.43 -35.68 68.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.07 0.462 . . . . 2.52 110.541 176.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -87.62 -39.63 14.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.041 -0.527 . . . . 2.87 110.481 174.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.683 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -53.7 -63.27 1.2 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.713 -0.676 . . . . 3.2 111.894 -177.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.694 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 11.1 pt-20 -66.11 -22.47 66.4 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 120.989 -0.284 . . . . 3.72 111.529 -177.754 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 44.3 t -64.44 -46.95 80.95 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.804 -0.443 . . . . 4.18 109.804 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 11.1 mpt_? -84.55 -13.46 51.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.36 0.6 . . . . 5.82 110.371 179.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.618 ' HB3' ' HA ' ' A' ' 162' ' ' GLU . 39.5 ttmt -82.64 -25.58 32.99 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.432 -0.804 . . . . 4.77 110.478 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -61.64 -38.04 95.21 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.796 -0.638 . . . . 5.1 112.575 -177.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -75.75 -20.69 58.11 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.948 0.404 . . . . 5.72 110.709 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -80.46 -2.78 47.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.157 -0.474 . . . . 5.88 110.122 176.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.437 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 3.9 tmt_? -73.45 -36.14 65.85 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.537 -0.912 . . . . 7.34 108.537 176.232 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -76.9 -26.0 53.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.505 -0.77 . . . . 6.97 109.558 176.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -86.19 -175.84 5.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.415 -0.811 . . . . 6.97 109.235 174.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 35.2 t60 -139.21 88.55 2.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.147 0.498 . . . . 9.35 109.916 173.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 173' ' ' HIS . . . . . 0.409 ' O ' ' HB3' ' A' ' 174' ' ' HIS . 11.7 t60 -103.58 141.86 35.29 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.146 -0.687 . . . . 11.4 109.146 178.647 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 174' ' ' HIS . . . . . 0.409 ' HB3' ' O ' ' A' ' 173' ' ' HIS . 57.3 t-80 72.86 136.8 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.981 0.801 . . . . 11.52 110.449 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -109.66 131.43 55.07 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.101 0.476 . . . . 14.48 110.998 -177.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 16.6 t60 -102.61 105.15 15.6 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.882 -0.784 . . . . 15.37 108.882 174.127 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 22.7 p80 -80.24 139.21 36.8 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.962 0.41 . . . . 16.02 110.635 -177.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 42.3 mt -82.94 166.73 18.63 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.878 -0.786 . . . . 17.99 108.878 175.024 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 66.71 112.63 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 O-C-N 123.678 0.611 . . . . 19.19 111.042 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 28.4 m-70 -83.81 -171.8 3.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.976 -0.557 . . . . 22.26 110.138 177.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -115.04 158.29 22.32 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.282 -0.417 . . . . 22.51 110.035 178.282 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -85.31 -42.87 14.22 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.854 -0.424 . . . . 24.89 109.854 -178.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -77.31 119.12 20.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.953 -0.567 . . . . 25.58 109.725 175.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -107.41 130.72 54.78 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.453 -0.573 . . . . 27.37 109.453 178.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 80.9 t60 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.764 -0.636 . . . . 29.06 110.338 -178.761 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B 1001 ' ' ACE . . . . . 0.479 ' H1 ' ' HA ' ' A' ' 71' ' ' GLN . . . . . . . . 0 C--O 1.234 0.255 . . . . . . . . 4.05 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -103.61 -143.58 12.85 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.941 -0.647 . . . . 2.97 112.039 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.515 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . 59.7 m 61.39 -158.71 0.33 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.618 0.247 . . . . 1.94 110.514 -179.167 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B 1004 ' ' VAL . . . . . . . . . . . . . 22.8 m 63.05 -20.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 N-CA-C 116.461 2.023 . . . . 1.63 116.461 162.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1005 ' ' GLY . . . . . 0.936 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . -94.42 5.25 70.64 Favored Glycine 0 N--CA 1.439 -1.165 0 C-N-CA 119.925 -1.131 . . . . 1.2 110.366 153.166 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B 1006 ' ' ARG . . . . . 0.442 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 7.4 mpt_? -121.46 -32.29 3.87 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.952 0.501 . . . . 2.88 111.878 174.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B 1007 ' ' ALA . . . . . 0.582 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -82.26 -54.14 5.48 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.256 -0.429 . . . . 1.31 112.114 -167.35 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.567 HD22 ' H ' ' B' 1008 ' ' LEU . 2.2 mm? -70.03 -31.69 69.45 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.076 -0.713 . . . . 1.33 109.076 -177.403 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B 1009 ' ' ALA . . . . . 1.028 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -49.89 -45.34 50.66 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.367 -1.288 . . . . 0.88 109.782 172.517 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.886 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -85.23 -49.41 8.22 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 113.178 -1.828 . . . . 1.03 111.498 -174.1 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.62 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 49.7 m-85 -65.58 -23.56 66.87 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.048 -0.524 . . . . 1.67 110.498 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.82 -11.35 83.52 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.932 -0.576 . . . . 0.78 112.934 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 32.6 t70 -71.84 -15.43 62.13 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.5 0.667 . . . . 1.9 109.654 170.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 32.6 m -111.35 82.27 1.58 Allowed 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.553 -0.749 . . . . 1.44 110.223 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.637 ' H ' HD12 ' B' 1015 ' ' ILE . 0.8 OUTLIER -95.28 -96.01 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 108.521 -0.918 . . . . 2.91 108.521 175.903 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B 1016 ' ' ASN . . . . . 0.497 ' H ' ' HB ' ' B' 1015 ' ' ILE . 27.4 p-10 -84.02 -7.7 59.33 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.732 -0.84 . . . . 4.29 108.732 170.202 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 72.8 mtp180 -96.89 86.78 4.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.844 -1.071 . . . . 8.17 110.169 -179.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.694 0 CA-C-N 116.524 -0.307 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.886 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.9 ptp . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 109.992 -0.373 . . . . 6.21 109.992 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.0 m -67.11 -35.3 79.47 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.108 0.48 . . . . 1.87 110.953 -178.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.726 ' HB3' ' HB3' ' A' ' 36' ' ' GLU . 26.3 mp0 -64.77 -10.65 29.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.968 -0.56 . . . . 2.42 111.072 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m -82.13 -17.92 44.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.167 -0.469 . . . . 1.25 111.068 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.767 ' HA ' HD22 ' A' ' 8' ' ' LEU . 76.2 m-20 -62.64 -22.1 66.18 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 121.218 0.532 . . . . 1.78 109.756 177.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.547 ' HA ' ' CB ' ' A' ' 131' ' ' ALA . 11.7 tpp85 -57.78 -43.53 85.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.276 -0.875 . . . . 1.4 110.573 176.57 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -61.58 -49.16 77.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.71 -0.677 . . . . 0.68 111.242 -177.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.767 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.3 OUTLIER -50.04 -32.99 16.83 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.129 -0.942 . . . . 1.16 111.383 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.449 HG11 ' HA ' ' A' ' 127' ' ' ALA . 79.5 t -79.53 -62.25 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.79 -0.641 . . . . 0.27 110.24 173.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.532 HG13 ' CE2' ' A' ' 24' ' ' TRP . 73.2 t -48.58 -54.73 4.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.504 -0.771 . . . . 0.33 112.553 -176.159 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -57.08 -37.49 71.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.094 -0.503 . . . . 0.59 110.524 -177.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.744 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 19.2 t80 -69.8 -46.49 65.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.939 -0.573 . . . . 1.61 110.501 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 1.056 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.9 mp -62.01 -39.48 92.39 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 120.98 -0.288 . . . . 0.34 110.45 178.296 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.3 m -58.63 -42.21 87.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.395 0.617 . . . . 1.05 110.205 176.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -67.47 -17.84 64.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.108 -0.951 . . . . 1.22 111.108 -178.259 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.632 ' HE2' ' HA ' ' A' ' 16' ' ' LYS . 10.4 mmpt? -85.96 -49.1 8.1 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.525 0.679 . . . . 1.41 109.777 -178.299 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.582 HD21 ' SG ' ' A' ' 111' ' ' CYS . 12.4 mt -59.33 -28.31 66.7 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.965 -1.016 . . . . 1.35 111.26 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.3 t -56.82 -43.88 81.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.427 -0.806 . . . . 0.94 111.678 177.197 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 12.4 pt20 -80.64 2.02 27.53 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.995 0.426 . . . . 1.37 111.587 -178.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.764 ' HE2' HG11 ' A' ' 112' ' ' VAL . 20.7 mmmt -107.39 -28.54 9.79 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.913 0.863 . . . . 2.2 109.032 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 22.25 10.4 Favored Glycine 0 N--CA 1.441 -0.999 0 CA-C-N 113.888 -1.505 . . . . 0.53 111.576 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -113.61 161.73 17.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.862 0.363 . . . . 0.76 110.691 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.3 t -102.33 145.94 28.75 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.998 -0.546 . . . . 0.52 110.259 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.532 ' CE2' HG13 ' A' ' 10' ' ' VAL . 48.2 t-105 -75.09 -51.77 12.68 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.598 -0.728 . . . . 3.36 109.192 174.471 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.407 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 4.8 m -60.01 -34.48 73.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.378 -0.828 . . . . 1.37 111.976 -174.239 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -61.45 -28.78 69.52 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.781 0.325 . . . . 1.11 111.536 -179.075 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -120.85 19.06 11.8 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.192 -0.458 . . . . 1.28 111.253 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.545 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 53.7 p -99.81 -178.72 3.95 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.592 0.71 . . . . 1.81 112.034 -172.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.527 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.0 OUTLIER -165.43 -25.69 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.429 -1.26 . . . . 2.31 109.304 -179.364 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.915 HG23 ' H ' ' A' ' 31' ' ' GLU . 10.7 m -50.63 -71.89 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 114.387 -1.279 . . . . 0.92 112.864 -173.623 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.915 ' H ' HG23 ' A' ' 30' ' ' VAL . 9.0 pt-20 -94.82 0.38 54.82 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.929 -0.767 . . . . 2.74 108.929 177.69 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.527 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 30.5 tt0 -70.61 -53.46 15.84 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.671 -1.15 . . . . 1.45 110.577 -178.008 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -97.21 -37.42 10.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.867 -0.606 . . . . 1.87 111.402 -175.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.408 ' O ' ' HA ' ' A' ' 31' ' ' GLU . 25.1 ptt180 -124.17 144.81 49.7 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.077 0.465 . . . . 3.39 111.185 179.604 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.2 p -116.76 111.93 20.45 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.51 0.672 . . . . 2.25 110.695 178.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.726 ' HB3' ' HB3' ' A' ' 3' ' ' GLN . 8.9 mm-40 -85.81 -71.75 0.52 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.349 -0.841 . . . . 3.34 110.7 -177.092 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.465 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -100.06 170.84 6.2 Favored Pre-proline 0 C--N 1.319 -0.75 0 CA-C-N 115.811 -0.631 . . . . 1.92 110.194 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.574 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 75.7 Cg_exo -53.21 170.4 0.34 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.881 2.388 . . . . 1.87 111.695 170.35 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -72.44 0.62 9.75 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 122.186 -0.321 . . . . 4.64 111.01 -179.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.432 ' HA2' ' OG ' ' A' ' 43' ' ' SER . . . 159.02 70.15 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.801 0 CA-C-N 115.901 -0.591 . . . . 2.15 111.734 176.754 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.645 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.5 OUTLIER -74.57 -73.06 0.25 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 120.754 -0.378 . . . . 1.12 110.757 -177.894 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.645 ' H ' HG23 ' A' ' 41' ' ' THR . 0.0 OUTLIER -91.85 -35.36 14.12 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 121.717 0.77 . . . . 2.02 109.486 172.883 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.745 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 27.9 p -54.42 -36.96 64.55 Favored 'General case' 0 C--O 1.212 -0.886 0 CA-C-N 114.19 -1.368 . . . . 1.25 113.122 -171.044 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -42.6 -40.49 2.71 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.694 0.627 . . . . 1.91 112.694 -171.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.582 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -87.51 -36.18 17.78 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 121.926 -0.484 . . . . 0.52 111.543 178.55 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.697 HG13 ' HA ' ' A' ' 43' ' ' SER . 0.7 OUTLIER -72.63 -37.07 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.894 -0.139 . . . . 1.41 111.18 -177.801 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.745 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.8 ptpt -67.15 -40.22 86.66 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.018 -0.734 . . . . 0.67 109.018 175.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.62 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 33.0 mm-40 -63.28 -34.62 78.07 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.317 -0.856 . . . . 0.99 110.953 176.118 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.51 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -72.67 -38.21 67.67 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.192 0.52 . . . . 0.42 110.841 178.587 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 mp -69.96 -23.88 63.25 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.624 -0.716 . . . . 1.33 112.508 -174.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.449 ' HD2' ' OE1' ' A' ' 48' ' ' GLN . 9.3 ptp180 -84.92 -25.49 27.87 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.95 0.881 . . . . 2.17 109.054 -175.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.62 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 10.7 mm-40 -78.05 -45.34 23.86 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.233 -1.349 . . . . 1.1 110.202 176.626 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.03 -40.57 91.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.005 -0.543 . . . . 0.53 110.129 174.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.737 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.35 -41.0 98.27 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.778 -0.646 . . . . 0.7 112.03 178.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.469 ' O ' HD22 ' A' ' 59' ' ' LEU . 19.6 t70 -55.09 -35.31 64.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.984 0.421 . . . . 1.04 110.767 -179.458 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.449 ' O ' HD21 ' A' ' 59' ' ' LEU . 29.4 mm-40 -73.3 -25.96 60.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.337 -0.847 . . . . 2.29 111.898 179.266 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.463 ' HE1' ' HA2' ' B' 1012 ' ' GLY . 66.2 t80 -83.51 -33.31 25.56 Favored 'General case' 0 C--N 1.316 -0.858 0 O-C-N 122.205 -0.309 . . . . 2.29 111.703 177.582 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.737 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 39.6 mt-10 -66.34 -54.02 29.41 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.575 0.583 . . . . 1.3 112.575 -167.215 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.562 HD23 ' N ' ' A' ' 59' ' ' LEU . 2.1 pt? -53.75 -36.67 62.58 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.696 -0.684 . . . . 1.54 110.775 -176.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 64.9 mtt180 -52.94 -55.65 21.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.54 -0.754 . . . . 2.58 111.717 -178.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.638 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 47.9 p90 -90.72 -4.5 56.66 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 121.134 -0.227 . . . . 5.32 111.119 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 53.3 ttp180 -54.34 -30.4 51.37 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 122.769 0.428 . . . . 4.48 111.646 -177.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.585 ' HD2' ' H ' ' A' ' 63' ' ' ARG . 3.3 mpt_? -66.54 -35.28 79.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.987 0.422 . . . . 4.72 110.641 179.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.538 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.35 -27.57 17.46 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.051 -0.522 . . . . 1.17 111.991 -179.107 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.58 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 51.6 t80 -41.67 -48.54 4.15 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.184 1.179 . . . . 2.81 114.184 -169.425 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.3 t -63.91 -44.25 93.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.932 0.396 . . . . 2.19 110.682 -173.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -72.63 -32.57 66.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.97 -0.559 . . . . 2.72 111.067 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 14.5 mt -58.87 -23.53 61.03 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 112.929 0.714 . . . . 1.56 112.929 -174.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.444 HG22 HG13 ' A' ' 74' ' ' ILE . 16.9 p -57.39 -26.27 60.82 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 118.33 0.514 . . . . 0.7 111.217 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -73.35 -24.81 60.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.712 -0.676 . . . . 1.34 109.938 177.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.429 ' OE1' HD22 ' A' ' 68' ' ' LEU . 61.1 mt-30 -87.41 -40.06 14.72 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.456 -0.793 . . . . 1.42 110.163 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.652 HD21 ' HZ ' ' A' ' 106' ' ' PHE . 3.3 mm? -65.56 -32.55 74.21 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.746 -0.465 . . . . 1.37 109.746 173.17 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 72.7 t60 66.33 44.33 2.48 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 107.673 -1.232 . . . . 2.72 107.673 -173.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.598 HG22 ' HE1' ' A' ' 119' ' ' MET . 26.3 mm -51.35 118.33 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 113.759 -1.564 . . . . 0.91 111.541 -179.507 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.773 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.32 -171.82 0.3 Allowed Pre-proline 0 C--N 1.316 -0.877 0 N-CA-C 107.301 -1.37 . . . . 0.51 107.301 -170.838 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.773 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 39.2 Cg_exo -29.07 165.36 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 125.07 3.847 . . . . 0.47 115.576 165.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.43 -28.53 0.01 OUTLIER Glycine 0 N--CA 1.475 1.279 0 N-CA-C 117.826 1.891 . . . . 0.4 117.826 -172.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.45 ' N ' ' O ' ' A' ' 76' ' ' PRO . 35.1 p -69.13 6.92 0.83 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 118.21 1.005 . . . . 0.56 112.476 -179.172 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.81 -11.84 60.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.244 0.545 . . . . 0.34 110.192 174.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -76.52 -18.06 58.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.961 -0.563 . . . . 4.13 109.673 175.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.431 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 32.8 mt-30 -84.27 -24.22 30.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.895 0.855 . . . . 1.03 109.329 173.498 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.5 m -71.48 -50.46 31.38 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.542 -1.208 . . . . 0.48 109.23 170.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -67.85 -18.69 64.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.252 -0.886 . . . . 1.18 110.167 175.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.585 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.7 tt0 -59.73 -52.17 66.63 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-O 121.605 0.717 . . . . 0.8 110.026 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.427 ' O ' ' HG2' ' A' ' 89' ' ' GLU . 57.4 mm-40 -47.47 -35.07 8.12 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.707 -1.588 . . . . 1.62 110.781 177.428 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.861 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -86.36 -49.76 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 CA-C-N 114.519 -1.219 . . . . 1.3 111.054 -175.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.585 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.7 p -62.81 -22.72 31.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.979 0.895 . . . . 0.85 109.361 -178.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.606 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 2.6 m-80 -71.08 -52.21 20.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.306 -1.315 . . . . 0.91 111.146 174.225 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 1.028 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.0 OUTLIER -67.51 -38.22 83.98 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-O 121.754 0.787 . . . . 2.87 109.346 -177.039 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.463 ' HG ' ' OE2' ' A' ' 89' ' ' GLU . 18.2 mt -63.01 -24.87 68.12 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 113.867 -1.515 . . . . 1.28 111.46 -178.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.651 ' HA ' HG22 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -110.27 -40.61 4.63 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 112.588 0.588 . . . . 2.3 112.588 -170.558 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.606 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER -67.8 -29.83 69.11 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.316 0.579 . . . . 5.06 110.784 -171.318 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.528 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 1.2 m-20 -98.88 17.22 20.05 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.353 -0.84 . . . . 3.12 112.972 -172.483 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.594 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 126.38 71.75 0.19 Allowed Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 117.18 -2.438 . . . . 2.31 115.758 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.651 HG22 ' HA ' ' A' ' 91' ' ' PHE . 57.8 t -71.42 102.73 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-N 118.977 1.388 . . . . 1.06 110.698 177.022 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -112.16 -172.53 2.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.848 -1.069 . . . . 2.12 110.143 -178.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.703 ' HD1' ' HB3' ' A' ' 145' ' ' ASN . 74.0 t90 -51.46 -49.43 61.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.408 -0.814 . . . . 3.34 111.799 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -86.36 -14.42 66.22 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 120.775 -0.726 . . . . 0.69 114.04 -174.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 94' ' ' GLY . 24.9 mmt180 -64.17 -45.01 90.27 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 117.459 0.63 . . . . 4.24 111.398 -176.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.643 ' HA ' ' CD1' ' A' ' 103' ' ' PHE . 66.7 mt -60.0 -30.83 46.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.51 -0.768 . . . . 0.44 111.542 -174.397 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 36.3 t -56.58 -54.63 26.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.653 -0.703 . . . . 1.35 110.384 171.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.78 -40.99 63.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.304 -0.862 . . . . 0.44 111.875 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.643 ' CD1' ' HA ' ' A' ' 100' ' ' ILE . 68.1 m-85 -50.42 -56.69 10.33 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.311 0.577 . . . . 1.49 110.56 177.009 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.634 ' HD1' ' HE3' ' A' ' 130' ' ' MET . 17.7 m-85 -75.57 -27.4 58.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.546 -0.752 . . . . 3.29 111.178 -174.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.744 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 47.2 m -62.81 -46.36 88.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.863 0.364 . . . . 1.19 110.452 178.308 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.652 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 56.5 t80 -80.84 -32.36 35.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.232 -0.44 . . . . 2.89 110.483 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.781 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.93 -40.42 95.37 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.64 -0.791 . . . . 0.3 111.9 176.264 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 1.056 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.51 -31.0 75.59 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 111.152 -0.779 . . . . 0.23 111.152 174.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.58 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -72.42 -32.66 66.52 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 110.02 -0.363 . . . . 0.31 110.02 176.142 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.433 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.2 OUTLIER -65.66 -36.23 83.06 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.833 0.825 . . . . 1.12 110.123 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.738 ' HB2' HD23 ' A' ' 13' ' ' LEU . 35.8 t -50.55 -48.01 57.51 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 114.468 -1.242 . . . . 0.26 109.233 172.06 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.764 HG11 ' HE2' ' A' ' 20' ' ' LYS . 92.3 t -71.04 -32.64 48.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.599 -0.728 . . . . 0.35 110.879 177.674 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.433 ' OE2' ' HA ' ' A' ' 110' ' ' LEU . 40.0 mt-10 -57.27 -34.46 68.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.26 0.552 . . . . 2.51 110.223 174.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.459 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 16.6 m -77.21 -35.06 55.97 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 115.682 -0.69 . . . . 0.28 109.312 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 111' ' ' CYS . 86.9 t -69.04 -35.21 67.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 121.91 0.862 . . . . 1.23 109.344 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -53.49 -49.28 67.84 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 113.547 -1.66 . . . . 0.6 111.374 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -88.15 13.09 12.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.856 -0.611 . . . . 1.62 110.387 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 61.09 52.34 4.06 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.723 0.773 . . . . 1.88 110.335 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.598 ' HE1' HG22 ' A' ' 74' ' ' ILE . 28.7 mtm -130.96 44.37 2.97 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 107.781 -1.192 . . . . 0.31 107.781 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.659 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 15.1 mp0 -60.02 -6.66 1.43 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.746 -1.116 . . . . 1.15 113.465 -172.739 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.559 HG23 HD22 ' A' ' 122' ' ' LEU . 31.4 m -65.96 -26.63 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 121.943 -0.473 . . . . 0.46 111.553 175.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.722 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.1 mm? -71.85 -27.13 62.68 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 110.373 -0.232 . . . . 0.26 110.373 -179.11 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.707 HG13 ' SG ' ' A' ' 111' ' ' CYS . 41.0 t -39.07 -55.56 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 O-C-N 124.33 1.019 . . . . 0.25 112.736 177.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.545 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 5.7 t -77.9 -30.54 50.71 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.642 -0.423 . . . . 1.35 110.773 -177.501 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.722 ' HD2' HD13 ' A' ' 122' ' ' LEU . 88.0 mtt180 -66.57 -48.78 68.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.204 -0.453 . . . . 2.67 110.997 -176.538 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.451 HD12 ' HA ' ' A' ' 111' ' ' CYS . 75.3 mt -53.66 -49.9 53.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.731 -0.668 . . . . 0.23 110.874 178.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.556 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.53 -36.99 69.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.996 -0.547 . . . . 0.29 112.046 -178.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.13 -57.85 10.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.459 0.647 . . . . 0.28 110.91 178.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -65.5 -37.32 86.45 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.695 -1.139 . . . . 3.91 111.02 -176.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.781 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 0.4 OUTLIER -61.9 -48.63 79.58 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.034 0.445 . . . . 1.08 111.091 179.712 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.547 ' CB ' ' HA ' ' A' ' 6' ' ' ARG . . . -67.75 -37.81 82.63 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 0.25 111.227 -178.059 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 96.9 m -65.57 -45.62 82.59 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.794 -0.363 . . . . 0.4 110.982 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.42 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 49.1 t80 -56.47 -43.36 79.53 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.554 -0.536 . . . . 3.13 109.554 177.236 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.985 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.4 OUTLIER -54.9 -61.33 2.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.764 -0.653 . . . . 0.95 109.786 170.992 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ASN . . . . . 0.404 ' HA ' HD22 ' A' ' 5' ' ' ASN . 4.8 m-80 -43.9 -56.17 4.08 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.3 -0.864 . . . . 0.46 112.808 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -76.94 -51.37 11.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.117 0.484 . . . . 0.59 111.925 -174.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' HIS . . . . . 0.42 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 0.4 OUTLIER -92.0 -51.56 5.14 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.982 0.734 . . . . 1.45 112.982 -170.261 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.985 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -79.51 -42.18 25.77 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 114.492 1.293 . . . . 1.2 114.492 -165.718 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.532 ' HB3' ' HD3' ' A' ' 140' ' ' PRO . 29.2 tt0 -44.09 -48.99 23.21 Favored Pre-proline 0 N--CA 1.472 0.643 0 N-CA-C 112.906 0.706 . . . . 0.75 112.906 -174.137 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.585 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.0 Cg_exo -52.91 -46.77 31.46 Favored 'Trans proline' 0 C--N 1.356 0.957 0 C-N-CA 121.949 1.766 . . . . 0.56 111.952 175.321 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -48.84 78.71 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.801 -0.636 . . . . 1.2 110.921 178.53 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.553 HD12 ' O ' ' A' ' 138' ' ' LEU . 1.7 mp -49.73 -47.75 21.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.142 0.496 . . . . 0.32 110.694 177.124 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.509 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 70.8 mm-40 -64.44 -29.59 70.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.538 -0.756 . . . . 0.57 111.991 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 19.1 mm-40 -62.15 -24.13 66.99 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.784 0.802 . . . . 0.78 110.006 176.007 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' ASN . . . . . 0.703 ' HB3' ' HD1' ' A' ' 97' ' ' TRP . 23.0 m-80 -104.89 10.98 34.15 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.5 -1.227 . . . . 0.93 109.715 -174.465 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 106.56 -12.54 42.89 Favored Glycine 0 N--CA 1.439 -1.164 0 CA-C-N 114.618 -1.174 . . . . 0.56 113.116 174.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' GLY . . . . . 0.517 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 102.29 174.45 27.44 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.366 -0.921 . . . . 0.49 112.098 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.411 ' HB3' ' CB ' ' A' ' 46' ' ' VAL . 56.0 m95 -63.97 -42.95 97.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.712 0.291 . . . . 3.57 110.936 -178.239 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.487 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 26.9 t70 -53.8 -48.99 69.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.609 . . . . 1.96 110.882 177.34 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.556 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 67.9 m -58.9 -34.6 71.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.724 -0.671 . . . . 0.67 111.501 179.773 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -60.45 -45.27 94.29 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.698 -0.482 . . . . 3.0 109.698 -179.258 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.582 HG21 ' HB1' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -72.62 -26.78 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.186 -0.461 . . . . 1.15 110.314 178.0 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 18.5 mm-40 -60.98 -29.98 70.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.952 0.406 . . . . 1.67 110.244 173.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.9 mt -94.1 -60.25 1.78 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.146 -0.479 . . . . 1.3 110.959 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 155' ' ' TYR . . . . . 0.687 ' HB2' ' HH2' ' A' ' 97' ' ' TRP . 3.2 t80 -121.05 26.37 9.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.338 0.59 . . . . 4.24 110.468 -172.41 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.51 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -61.45 162.59 24.39 Favored Glycine 0 CA--C 1.499 -0.966 0 CA-C-N 115.716 -0.675 . . . . 1.1 112.83 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.579 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 26.4 t-20 -55.6 111.58 0.93 Allowed 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 114.12 -1.04 . . . . 1.29 110.754 178.085 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 158' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -100.43 -3.61 30.62 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 121.32 0.581 . . . . 2.99 109.918 -176.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.82 -47.2 86.68 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.004 -0.544 . . . . 2.52 110.271 175.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.98 -36.44 83.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.809 -0.632 . . . . 2.87 110.369 174.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -59.12 -48.33 81.98 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.558 -0.746 . . . . 3.2 110.768 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -68.61 -31.72 71.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.959 -0.564 . . . . 3.72 111.234 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 70.1 m -61.43 -47.61 84.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.936 0.398 . . . . 4.18 110.849 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -90.89 0.04 57.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.495 -0.32 . . . . 5.82 111.798 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -63.27 -43.14 98.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.641 0.258 . . . . 4.77 111.61 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -57.79 -59.45 10.81 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.204 -0.522 . . . . 5.1 112.832 -175.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -71.89 -17.21 62.13 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 111.979 0.362 . . . . 5.72 111.979 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -69.57 -18.12 63.61 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.343 0.592 . . . . 5.88 110.049 177.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.641 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 1.1 tmt_? -91.19 -17.8 25.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.347 0.594 . . . . 7.34 109.442 -177.584 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 170' ' ' LEU . 4.0 mm? -87.17 28.97 0.87 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.865 -0.607 . . . . 6.97 111.045 -177.127 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -85.8 -0.28 54.87 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.854 -0.612 . . . . 6.97 110.699 -177.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 35.3 m80 -73.84 -6.67 48.49 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.235 0.541 . . . . 9.35 110.388 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -158.27 173.18 17.08 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.367 -0.975 . . . . 11.4 108.367 176.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -80.68 91.8 5.91 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 119.975 -0.69 . . . . 11.52 110.094 179.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 30.9 p-80 -77.87 136.91 38.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.739 -0.664 . . . . 14.48 110.156 -178.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -96.09 -52.57 3.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.562 -0.29 . . . . 15.37 110.994 -177.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 85.7 t60 61.69 96.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 O-C-N 123.858 0.724 . . . . 16.02 110.667 -176.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 89.7 mt -69.66 130.1 41.45 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.772 -0.649 . . . . 17.99 110.542 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -113.43 104.65 12.5 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.802 -0.635 . . . . 19.19 109.413 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 47.3 t-80 -91.84 102.69 15.29 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.242 0.544 . . . . 22.26 110.734 -176.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -132.23 -26.2 1.91 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.664 -0.698 . . . . 22.51 109.761 176.26 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 38.4 m80 -79.98 138.24 37.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.062 -0.517 . . . . 24.89 110.317 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -103.98 -178.78 3.76 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.021 -0.536 . . . . 25.58 110.462 -177.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 37.8 p-80 -143.59 129.42 19.39 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.364 -0.38 . . . . 27.37 110.077 175.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 42.6 t60 . . . . . 0 C--O 1.247 0.926 0 CA-C-O 118.322 -0.847 . . . . 29.06 109.557 -179.743 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.239 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -83.03 57.2 5.08 Favored Glycine 0 N--CA 1.451 -0.341 0 O-C-N 121.561 -0.712 . . . . 2.97 112.078 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.513 ' O ' HG22 ' B' 1004 ' ' VAL . 22.3 m -119.89 -140.31 0.34 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 110.032 -0.359 . . . . 1.94 110.032 -178.363 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.536 ' C ' ' H ' ' B' 1006 ' ' ARG . 1.7 m 52.13 -178.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 C-N-CA 125.11 1.364 . . . . 1.63 111.761 -174.277 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 1005 ' ' GLY . . . . . 0.904 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . 46.25 5.35 0.01 OUTLIER Glycine 0 CA--C 1.541 1.679 0 C-N-CA 120.93 -0.652 . . . . 1.2 114.188 -160.706 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 1006 ' ' ARG . . . . . 0.536 ' H ' ' C ' ' B' 1004 ' ' VAL . 24.2 mmt180 -139.51 -41.58 0.45 Allowed 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 123.446 0.698 . . . . 2.88 109.754 177.184 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 1007 ' ' ALA . . . . . 0.526 ' O ' ' HD1' ' B' 1011 ' ' PHE . . . -59.9 -61.06 2.89 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 116.19 -0.459 . . . . 1.31 111.307 -177.847 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.838 HD22 ' H ' ' B' 1008 ' ' LEU . 1.0 OUTLIER -63.45 -39.8 95.43 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.49 -0.93 . . . . 1.33 108.49 -179.19 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B 1009 ' ' ALA . . . . . 1.028 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -48.6 -49.97 34.6 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.521 -1.218 . . . . 0.88 110.58 172.213 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.91 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -78.18 -43.52 28.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.704 -1.135 . . . . 1.03 112.021 -175.136 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.603 ' HE1' ' H8 ' ' B' 1100 ' ' 33B . 46.3 m-85 -67.14 -26.73 66.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.223 0.535 . . . . 1.67 110.42 178.534 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 1012 ' ' GLY . . . . . 0.463 ' HA2' ' HE1' ' A' ' 57' ' ' PHE . . . -79.93 -6.77 88.98 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.45 -0.796 . . . . 0.78 112.606 178.24 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 26.9 t70 -81.59 -2.95 51.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.483 0.658 . . . . 1.9 109.941 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 20.2 m -91.08 19.74 5.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.883 -0.599 . . . . 1.44 111.045 -178.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.512 HG13 ' H ' ' B' 1017 ' ' ARG . 13.9 pt -82.54 -151.65 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 2.91 110.601 176.373 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 1016 ' ' ASN . . . . . 0.423 ' H ' ' HB ' ' B' 1015 ' ' ILE . 25.4 p-10 -62.89 -29.84 71.07 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.946 0.403 . . . . 4.29 110.518 175.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 1017 ' ' ARG . . . . . 0.512 ' H ' HG13 ' B' 1015 ' ' ILE . 42.6 mtp180 -133.81 94.13 3.23 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.842 -0.617 . . . . 8.17 110.402 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.626 0 CA-C-N 116.424 -0.353 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.91 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.8 mtm . . . . . 0 N--CA 1.484 1.233 0 CA-C-O 120.656 0.265 . . . . 6.21 110.853 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.1 m -85.81 108.21 18.0 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.811 -0.44 . . . . 1.87 109.811 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.639 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 76.4 mm-40 -71.22 2.2 5.0 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.418 0.895 . . . . 2.42 113.418 -171.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.0 p -68.68 -18.31 64.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.109 0.48 . . . . 1.25 110.626 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.762 ' HB2' HD13 ' A' ' 134' ' ' LEU . 13.2 p30 -68.88 -20.76 64.27 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.029 -0.532 . . . . 1.78 111.06 176.304 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.639 ' HB2' ' O ' ' A' ' 3' ' ' GLN . 0.1 OUTLIER -51.96 -51.77 54.88 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.801 -0.636 . . . . 1.4 110.31 175.95 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.555 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 40.2 mt-10 -59.39 -48.2 82.56 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.867 -1.06 . . . . 0.68 111.453 -176.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.668 HD22 ' HA ' ' A' ' 5' ' ' ASN . 1.4 mp -49.61 -34.55 18.28 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.439 -0.8 . . . . 1.16 111.087 176.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.564 HG21 ' N ' ' A' ' 131' ' ' ALA . 72.6 t -79.39 -63.1 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.498 0.666 . . . . 0.27 109.909 174.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 6' ' ' ARG . 93.6 t -50.66 -56.6 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.471 -1.241 . . . . 0.33 112.766 -174.715 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.08 -33.08 68.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.709 0.29 . . . . 0.59 110.469 -177.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 4.0 t80 -74.97 -46.2 37.03 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.287 -0.415 . . . . 1.61 110.735 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.95 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.9 mp -62.72 -40.79 98.3 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 120.103 -0.639 . . . . 0.34 110.202 178.238 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.8 t -61.17 -40.7 94.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.172 0.51 . . . . 1.05 110.065 176.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.431 ' HD2' ' HE3' ' A' ' 16' ' ' LYS . 81.3 t80 -63.15 -22.1 66.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.529 -0.759 . . . . 1.22 110.889 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.724 ' HE2' ' HA ' ' A' ' 16' ' ' LYS . 10.5 mmpt? -86.35 -43.75 12.62 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.516 0.674 . . . . 1.41 110.203 -179.057 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.658 HD21 ' SG ' ' A' ' 111' ' ' CYS . 14.5 mt -66.69 -30.86 71.2 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 115.018 -0.992 . . . . 1.35 110.69 178.162 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.0 t -56.31 -43.51 79.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.541 -0.754 . . . . 0.94 111.564 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.406 ' HG3' ' O ' ' A' ' 16' ' ' LYS . 6.8 pt20 -80.22 0.97 30.22 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.073 0.463 . . . . 1.37 112.103 -177.413 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.657 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 19.9 mmmt -108.28 -26.5 10.51 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 122.113 0.959 . . . . 2.2 108.788 177.42 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 22.28 10.37 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 113.642 -1.617 . . . . 0.53 111.47 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.713 ' HB3' ' HE2' ' A' ' 27' ' ' PHE . 89.9 m-85 -113.13 156.39 23.27 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.855 0.36 . . . . 0.76 110.879 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.7 t -93.13 147.75 22.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.811 -0.631 . . . . 0.52 110.688 -179.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -73.33 -53.01 11.84 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.794 -0.639 . . . . 3.36 110.022 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -68.4 -28.89 67.49 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.186 0.439 . . . . 1.37 112.186 -173.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -61.22 -29.63 69.94 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.672 -0.411 . . . . 1.11 111.363 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.713 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 13.5 m-85 -109.96 -15.34 14.09 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.3 -0.409 . . . . 1.28 111.338 -175.53 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.677 ' HB3' HG22 ' A' ' 30' ' ' VAL . 34.6 m -101.36 148.34 25.27 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 122.254 1.026 . . . . 1.81 112.632 -176.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.29 -2.84 11.07 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 113.113 -1.858 . . . . 2.31 109.149 -177.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.911 HG23 ' H ' ' A' ' 31' ' ' GLU . 5.2 m -64.66 -75.76 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 114.636 -1.166 . . . . 0.92 113.141 -169.132 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.911 ' H ' HG23 ' A' ' 30' ' ' VAL . 10.2 mm-40 -85.24 -2.28 57.87 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 122.075 0.94 . . . . 2.74 108.861 -179.191 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -64.67 -41.29 96.19 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.188 -1.369 . . . . 1.45 110.425 174.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.5 m-80 -106.0 -9.05 17.24 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.924 -0.58 . . . . 1.87 112.198 -173.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.595 ' HG2' ' O ' ' A' ' 30' ' ' VAL . 19.3 ptp180 -128.71 155.93 44.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.017 0.437 . . . . 3.39 111.245 -177.57 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.9 p -127.9 102.95 7.0 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.777 -0.647 . . . . 2.25 109.611 174.392 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.471 ' OE2' ' HD3' ' A' ' 34' ' ' ARG . 56.6 mt-10 -138.57 -69.24 0.44 Allowed 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.64 -0.709 . . . . 3.34 111.05 -171.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.49 ' HB1' ' HG3' ' A' ' 7' ' ' GLU . . . -73.83 136.45 76.98 Favored Pre-proline 0 C--N 1.322 -0.615 0 C-N-CA 120.845 -0.342 . . . . 1.92 110.9 177.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.853 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 26.2 Cg_exo -64.52 -175.03 0.31 Allowed 'Trans proline' 0 CA--C 1.53 0.299 0 C-N-CA 123.404 2.736 . . . . 1.87 111.794 173.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -83.94 -8.53 59.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.524 0.678 . . . . 4.64 109.836 176.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.416 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 159.44 71.55 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.874 0 CA-C-N 115.028 -0.987 . . . . 2.15 111.318 -176.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.853 ' HB ' ' HG2' ' A' ' 38' ' ' PRO . 1.2 t -71.62 -75.27 0.13 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.538 -0.465 . . . . 1.12 110.408 -175.631 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.812 ' H ' HG23 ' A' ' 41' ' ' THR . 17.0 pt-20 -94.7 -23.51 17.54 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 122.999 1.38 . . . . 2.02 108.291 165.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.843 ' HB2' ' HE3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -63.04 -30.0 71.25 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 111.955 -2.384 . . . . 1.25 114.562 -169.725 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -46.19 -50.31 15.88 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 118.202 0.455 . . . . 1.91 111.614 -173.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.604 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -74.93 -37.75 61.96 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.982 0.42 . . . . 0.52 110.368 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.626 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 72.2 t -54.93 -65.21 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.37 -0.832 . . . . 1.41 111.306 177.132 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.843 ' HE3' ' HB2' ' A' ' 43' ' ' SER . 19.3 ptpt -60.85 -34.51 74.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.865 -0.607 . . . . 0.67 110.176 -176.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.458 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 38.3 mm-40 -62.34 -36.36 81.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.64 -0.709 . . . . 0.99 111.446 174.264 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.774 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -76.85 -35.25 57.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.497 0.665 . . . . 0.42 110.066 175.261 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.577 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -54.85 -39.29 68.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.742 -1.117 . . . . 1.33 112.118 -179.771 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.405 ' HG2' ' H ' ' A' ' 51' ' ' ARG . 13.0 ptp180 -79.59 -33.53 41.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.588 0.709 . . . . 2.17 109.426 -174.381 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.677 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.0 mm-40 -67.95 -43.67 78.52 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.582 -1.19 . . . . 1.1 110.218 178.082 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.57 -41.49 72.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.495 -0.775 . . . . 0.53 110.723 177.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.697 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.41 -44.62 97.36 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.825 -0.625 . . . . 0.7 112.52 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.57 ' O ' HD22 ' A' ' 59' ' ' LEU . 28.8 t70 -54.33 -32.01 55.64 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.074 0.464 . . . . 1.04 111.294 -178.279 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -80.22 -25.6 39.54 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.379 -0.828 . . . . 2.29 112.488 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.633 ' CZ ' HD12 ' B' 1008 ' ' LEU . 91.7 t80 -82.54 -43.05 17.59 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.566 0.58 . . . . 2.29 112.566 -179.412 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.697 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 30.4 mt-10 -58.33 -48.03 81.85 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.494 0.924 . . . . 1.3 113.494 -168.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.62 ' H ' ' CD2' ' A' ' 59' ' ' LEU . 1.0 OUTLIER -78.74 -7.81 58.13 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 123.717 0.807 . . . . 1.54 112.409 -172.119 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 67.8 mtt-85 -45.01 -27.39 0.54 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 116.221 1.934 . . . . 2.58 116.221 -161.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -90.38 -85.94 0.21 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 117.16 -1.816 . . . . 5.32 109.894 174.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 56.6 mtm180 -109.18 -82.06 0.57 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 119.534 1.061 . . . . 4.48 111.636 158.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.673 ' HB2' ' OD1' ' A' ' 67' ' ' ASP . 0.0 OUTLIER -103.07 11.65 36.93 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 113.844 -1.525 . . . . 4.72 110.966 171.182 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.739 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -27.89 -54.99 0.1 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.378 1.622 . . . . 1.17 115.378 -150.371 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.453 ' CG ' ' HB3' ' A' ' 58' ' ' GLU . 19.6 p90 -47.82 -28.57 2.64 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 113.088 0.773 . . . . 2.81 113.088 -176.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.7 m -90.69 -36.66 14.22 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.202 0.445 . . . . 2.19 112.202 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.673 ' OD1' ' HB2' ' A' ' 63' ' ' ARG . 4.5 m-20 -83.01 -23.21 33.37 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.799 0.296 . . . . 2.72 111.799 -174.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.739 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 32.2 mt -61.47 -15.55 38.61 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.717 1.006 . . . . 1.56 113.717 -171.675 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.72 HG22 HG13 ' A' ' 74' ' ' ILE . 34.4 p -47.81 -29.27 3.06 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 123.314 0.384 . . . . 0.7 111.482 -177.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.8 t -53.28 -59.38 4.64 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.752 -0.658 . . . . 1.34 111.143 175.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.494 ' OE1' ' HA ' ' A' ' 68' ' ' LEU . 3.1 mp0 -54.51 -48.09 72.31 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.682 0.793 . . . . 1.42 111.814 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.75 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.1 mp -81.25 -28.27 34.84 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.104 -0.953 . . . . 1.37 111.922 -168.081 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.5 t-80 62.8 64.38 0.89 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 122.155 0.978 . . . . 2.72 108.711 -177.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.72 HG13 HG22 ' A' ' 69' ' ' THR . 15.5 mm -65.03 118.54 7.54 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 113.963 -1.472 . . . . 0.91 111.627 -174.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.729 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.26 -172.18 0.3 Allowed Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 107.47 -1.307 . . . . 0.51 107.47 -171.247 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.729 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.3 Cg_exo -30.33 167.27 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 125.035 3.823 . . . . 0.47 115.112 164.005 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.41 -25.68 0.0 OUTLIER Glycine 0 N--CA 1.475 1.239 0 N-CA-C 117.606 1.803 . . . . 0.4 117.606 -174.375 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.473 ' N ' ' O ' ' A' ' 76' ' ' PRO . 34.6 p -72.05 6.76 1.95 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 118.119 0.959 . . . . 0.56 111.514 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.46 -16.71 61.81 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 109.304 -0.628 . . . . 0.34 109.304 169.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.543 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 66.2 t80 -76.06 -15.12 60.17 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.574 -0.739 . . . . 4.13 109.186 174.325 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.501 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 78.1 mt-30 -82.85 -28.79 29.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.766 0.793 . . . . 1.03 109.487 172.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.75 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.5 m -72.05 -53.14 13.8 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.58 -1.191 . . . . 0.48 109.687 173.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.511 ' HE1' ' HB3' ' A' ' 106' ' ' PHE . 78.8 t80 -65.13 -18.94 65.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.559 -0.746 . . . . 1.18 110.345 175.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.64 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.6 tt0 -60.59 -46.91 88.48 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 115.724 -0.671 . . . . 0.8 110.426 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -49.1 -34.6 14.25 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.749 -1.114 . . . . 1.62 110.796 177.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.808 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.4 t -82.68 -54.72 8.84 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.025 -0.988 . . . . 1.3 110.867 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.64 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.8 p -60.46 -25.31 33.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.537 0.684 . . . . 0.85 109.648 -177.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -62.08 -56.5 18.27 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.789 -1.096 . . . . 0.91 110.742 171.607 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.917 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.0 OUTLIER -62.05 -36.36 81.4 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 108.428 -0.953 . . . . 2.87 108.428 -175.738 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.782 HD23 ' HE ' ' A' ' 99' ' ' ARG . 27.3 mt -70.9 -24.28 62.44 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 113.672 -1.603 . . . . 1.28 112.345 -170.159 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.742 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 1.7 p90 -106.81 -23.56 12.35 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.052 0.453 . . . . 2.3 111.516 -176.31 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.531 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 5.8 ptm180 -88.18 -41.56 12.9 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.889 0.376 . . . . 5.06 111.71 -172.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -100.83 18.11 20.34 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.824 0.676 . . . . 3.12 112.824 -165.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.528 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 129.03 69.38 0.12 Allowed Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 117.574 -2.25 . . . . 2.31 114.846 178.137 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.742 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 61.1 t -70.7 103.94 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 118.421 1.111 . . . . 1.06 110.416 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -110.93 -175.06 2.62 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.973 -1.012 . . . . 2.12 108.427 176.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.535 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 21.8 m-90 -54.72 -47.33 73.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.008 0.432 . . . . 3.34 110.27 178.283 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.692 ' HA3' ' HB ' ' B' 1015 ' ' ILE . . . -69.13 -30.47 71.9 Favored Glycine 0 CA--C 1.519 0.317 0 CA-C-N 115.738 -0.664 . . . . 0.69 113.772 -176.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.782 ' HE ' HD23 ' A' ' 90' ' ' LEU . 9.9 mmm-85 -62.68 -35.61 80.23 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.4 0.619 . . . . 4.24 110.798 -178.006 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.508 ' O ' ' HB3' ' A' ' 103' ' ' PHE . 72.5 mt -75.01 -41.25 45.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 CA-C-N 115.53 -0.759 . . . . 0.44 110.812 -177.466 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -59.53 -35.93 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 109.671 -0.492 . . . . 1.35 109.671 174.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.16 87.27 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.786 -0.643 . . . . 0.44 110.632 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.535 ' HZ ' ' HA ' ' A' ' 130' ' ' MET . 67.4 t80 -51.9 -42.87 63.06 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.13 -0.941 . . . . 1.49 110.12 173.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.841 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 89.0 m-85 -75.41 -39.7 58.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.076 -0.511 . . . . 3.29 111.367 178.006 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.49 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 19.3 m -56.16 -50.13 72.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.063 0.459 . . . . 1.19 110.365 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.511 ' HB3' ' HE1' ' A' ' 83' ' ' PHE . 1.2 t80 -79.07 -35.42 42.47 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.95 -0.568 . . . . 2.89 110.569 -178.226 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.673 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.06 -43.46 95.7 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.75 -0.738 . . . . 0.3 111.999 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.95 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.64 -33.02 79.7 Favored Glycine 0 N--CA 1.443 -0.89 0 N-CA-C 110.875 -0.89 . . . . 0.23 110.875 175.666 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.77 -34.25 73.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.47 -0.365 . . . . 0.31 110.606 176.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.538 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.47 -39.57 94.81 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 108.257 -1.016 . . . . 1.12 108.257 -178.806 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.679 ' SG ' HG22 ' A' ' 123' ' ' VAL . 43.9 t -52.78 -52.6 56.04 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 113.899 -1.5 . . . . 0.26 109.913 173.167 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.568 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 92.6 t -68.07 -38.43 79.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.97 -0.559 . . . . 0.35 111.686 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.5 ' HB3' HG21 ' A' ' 74' ' ' ILE . 35.7 mt-10 -58.11 -28.17 64.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.158 0.504 . . . . 2.51 110.027 176.521 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.46 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 50.8 m -79.01 -41.28 29.29 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.859 -0.61 . . . . 0.28 109.503 176.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 111' ' ' CYS . 88.0 t -64.04 -33.92 65.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 122.066 0.936 . . . . 1.23 109.455 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ASP . . . . . 0.454 ' OD1' ' HD3' ' A' ' 117' ' ' LYS . 15.2 t70 -51.54 -50.39 60.14 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 113.401 -1.727 . . . . 0.6 111.278 178.186 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.454 ' HD3' ' OD1' ' A' ' 116' ' ' ASP . 12.1 mmtp -88.33 13.3 11.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.061 -0.518 . . . . 1.62 110.231 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.446 ' HA ' HE21 ' A' ' 120' ' ' GLN . 44.4 mt-10 63.2 42.84 6.76 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-O 121.657 0.742 . . . . 1.88 110.749 -177.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.46 ' CE ' ' HA ' ' A' ' 114' ' ' SER . 29.7 mtm -116.16 46.29 1.6 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.069 -1.086 . . . . 0.31 108.069 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.446 HE21 ' HA ' ' A' ' 118' ' ' GLU . 3.7 mt-30 -61.61 -7.45 3.35 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.468 -1.242 . . . . 1.15 112.847 -175.84 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.562 HG23 HD22 ' A' ' 122' ' ' LEU . 27.8 m -65.82 -27.31 40.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 122.244 -0.285 . . . . 0.46 111.067 173.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.693 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -70.8 -29.45 65.64 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 116.569 -0.287 . . . . 0.26 110.321 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.679 HG22 ' SG ' ' A' ' 111' ' ' CYS . 76.3 t -43.05 -55.5 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 O-C-N 124.001 0.813 . . . . 0.25 111.909 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.579 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 2.9 t -70.32 -35.0 73.36 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.779 0.323 . . . . 1.35 110.914 -178.103 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.693 ' HD2' HD13 ' A' ' 122' ' ' LEU . 94.7 mtt180 -63.47 -56.02 19.46 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 121.13 0.491 . . . . 2.67 110.158 -178.243 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.538 HD13 ' HB3' ' A' ' 110' ' ' LEU . 68.8 mt -51.82 -53.72 16.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.139 -0.937 . . . . 0.23 110.964 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.532 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -54.84 -34.45 62.87 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 111.711 0.263 . . . . 0.29 111.711 -178.508 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.13 -58.05 8.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.48 0.657 . . . . 0.28 110.892 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -68.76 -26.1 65.05 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.026 -0.988 . . . . 3.91 111.224 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.673 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 21.5 mmm -62.87 -60.57 3.29 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.168 -0.469 . . . . 1.08 110.683 176.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.564 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -62.37 -35.11 78.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.173 -0.467 . . . . 0.25 110.972 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 89.6 m -63.71 -47.47 80.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.336 -0.393 . . . . 0.4 111.261 176.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.408 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 3.4 t80 -60.35 -37.35 80.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.96 -0.385 . . . . 3.13 109.96 179.708 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.841 HD12 ' HZ ' ' A' ' 104' ' ' PHE . 5.9 tt -64.1 -50.2 69.21 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.752 -0.832 . . . . 0.95 108.752 173.283 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -47.95 -57.37 5.82 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.878 -0.601 . . . . 0.46 112.028 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -80.85 -48.85 11.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.398 0.518 . . . . 0.59 112.398 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' HIS . . . . . 0.408 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 0.3 OUTLIER -90.77 -47.81 7.41 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.127 0.788 . . . . 1.45 113.127 -169.007 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 58.2 mt -91.04 -32.89 15.73 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.011 0.745 . . . . 1.2 113.011 -165.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.629 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 29.6 tt0 -49.67 -50.23 68.07 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 111.915 0.339 . . . . 0.75 111.915 -174.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.613 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 13.3 Cg_endo -57.83 -49.7 12.36 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.902 1.735 . . . . 0.56 111.913 175.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' TRP . . . . . 0.42 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -56.02 -47.41 77.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.721 -0.672 . . . . 1.2 110.471 179.282 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.545 HD12 ' HA ' ' A' ' 139' ' ' GLU . 15.0 mt -50.15 -50.86 19.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.609 -0.723 . . . . 0.32 111.27 175.2 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.629 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 80.8 mm-40 -58.84 -34.09 71.18 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.572 -0.74 . . . . 0.57 111.252 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.613 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 6.1 mm-40 -66.57 -21.71 66.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.381 0.61 . . . . 0.78 110.773 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -102.42 -4.95 24.68 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.504 -0.771 . . . . 0.93 109.787 -174.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 123.13 -31.92 4.54 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.479 -0.782 . . . . 0.56 112.851 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' GLY . . . . . 0.501 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 123.45 -175.48 16.71 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.731 -0.747 . . . . 0.49 112.046 -178.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.475 ' NE1' HD13 ' A' ' 142' ' ' ILE . 11.2 m-90 -78.68 -39.69 36.01 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.839 0.352 . . . . 3.57 110.38 -178.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -61.98 -42.21 98.88 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.109 -0.496 . . . . 1.96 110.07 179.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.607 ' O ' HD13 ' A' ' 154' ' ' LEU . 85.0 m -57.4 -35.5 70.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.768 -0.651 . . . . 0.67 110.869 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.535 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 78.7 t80 -60.66 -39.84 89.85 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 120.43 -0.508 . . . . 3.0 110.102 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.604 HG21 ' HB1' ' A' ' 45' ' ' ALA . 1.3 m -78.18 -26.19 14.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.158 0.504 . . . . 1.15 110.331 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -59.33 -42.32 91.19 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.399 0.619 . . . . 1.67 109.695 171.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.607 HD13 ' O ' ' A' ' 150' ' ' THR . 8.1 mp -80.37 -60.04 2.47 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.093 -0.958 . . . . 1.3 112.873 177.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -119.86 27.04 8.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.272 0.558 . . . . 4.24 110.203 -168.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.774 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -57.17 161.69 8.22 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-O 122.022 0.79 . . . . 1.1 114.665 -178.788 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.677 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 28.1 t-20 -50.68 140.0 15.33 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 113.202 -1.499 . . . . 1.29 111.601 178.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.671 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 2.5 m120 -66.3 -29.18 69.33 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.427 0.528 . . . . 2.99 112.427 -174.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.415 ' HB3' ' OD1' ' A' ' 157' ' ' ASN . . . -60.59 -28.34 68.41 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.112 0.482 . . . . 2.52 110.056 175.509 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -87.18 -34.53 18.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.972 -0.558 . . . . 2.87 110.052 174.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.5 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -59.99 -51.6 68.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.917 -0.583 . . . . 3.2 111.072 177.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.671 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 5.8 pt-20 -62.23 -27.75 69.21 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.664 0.268 . . . . 3.72 111.399 175.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 12.5 t -70.5 -29.59 66.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.407 0.622 . . . . 4.18 109.548 178.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 -79.07 -40.32 31.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.671 0.748 . . . . 5.82 109.791 172.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -58.44 -42.25 86.93 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.622 -1.172 . . . . 4.77 110.652 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -66.02 -40.69 95.32 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.833 -0.621 . . . . 5.1 112.873 -178.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -74.91 -30.19 61.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 117.163 0.482 . . . . 5.72 110.375 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.779 ' HA ' ' HB2' ' A' ' 171' ' ' GLU . 47.8 mt-10 -82.72 10.49 7.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 5.88 110.682 176.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.505 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 0.2 OUTLIER -79.91 -26.16 40.29 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.526 -0.916 . . . . 7.34 108.526 174.778 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -90.63 -33.63 15.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.39 -0.823 . . . . 6.97 109.377 171.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 171' ' ' GLU . . . . . 0.779 ' HB2' ' HA ' ' A' ' 168' ' ' GLU . 8.5 mm-40 -73.93 -175.73 2.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.055 -0.975 . . . . 6.97 110.401 176.295 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -127.95 129.11 46.27 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.237 -0.438 . . . . 9.35 109.838 173.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -65.8 114.88 5.38 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.458 0.647 . . . . 11.4 111.047 -175.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 45.4 p-80 -128.27 138.64 52.51 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.13 -0.941 . . . . 11.52 109.879 -177.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -79.58 10.92 3.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.322 -0.399 . . . . 14.48 111.688 -172.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 65.75 82.95 0.17 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.126 -0.488 . . . . 15.37 111.07 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 63.26 53.21 2.26 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.622 -0.717 . . . . 16.02 111.121 175.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 7.7 mp 63.64 -158.73 0.31 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.777 -0.647 . . . . 17.99 111.401 177.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -132.46 -28.42 1.66 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.191 -0.459 . . . . 19.19 110.633 177.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 -141.73 104.42 4.53 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.985 -0.552 . . . . 22.26 109.944 178.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 70.9 m80 -70.25 170.85 10.84 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.897 -0.592 . . . . 22.51 110.594 178.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -130.09 110.1 11.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.445 -0.343 . . . . 24.89 110.319 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -125.47 144.49 50.51 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.432 -0.349 . . . . 25.58 110.431 176.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -66.2 -42.12 89.25 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.985 -0.552 . . . . 27.37 111.431 -174.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 30.1 p-80 . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.297 -0.858 . . . . 29.06 110.353 -178.889 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.239 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -69.02 -31.11 72.13 Favored Glycine 0 N--CA 1.45 -0.425 0 N-CA-C 111.623 -0.591 . . . . 2.97 111.623 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.682 ' HB3' ' O62' ' B' 1100 ' ' 33B . 22.4 m -110.65 -143.34 0.39 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.329 -0.619 . . . . 1.94 109.329 175.597 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.92 HG23 ' H ' ' B' 1005 ' ' GLY . 32.2 m 43.39 -84.58 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 124.547 1.139 . . . . 1.63 113.546 175.526 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 1005 ' ' GLY . . . . . 0.92 ' H ' HG23 ' B' 1004 ' ' VAL . . . -32.35 -38.01 0.05 OUTLIER Glycine 0 CA--C 1.53 1.013 0 CA-C-N 118.895 0.771 . . . . 1.2 113.014 160.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 1006 ' ' ARG . . . . . 0.514 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 3.7 mpt_? -90.59 -41.74 11.18 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.776 0.322 . . . . 2.88 111.241 175.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 1007 ' ' ALA . . . . . 0.421 ' HA ' ' C7 ' ' B' 1100 ' ' 33B . . . -70.32 -66.13 0.64 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.466 0.543 . . . . 1.31 112.466 -171.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.633 HD12 ' CZ ' ' A' ' 57' ' ' PHE . 3.3 mm? -57.5 -40.04 77.83 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.312 0.577 . . . . 1.33 110.18 -173.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 1009 ' ' ALA . . . . . 0.917 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -53.92 -40.19 66.48 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.642 -1.163 . . . . 0.88 110.726 176.415 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.885 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -80.25 -41.22 25.48 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.827 -1.078 . . . . 1.03 111.143 -177.493 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.559 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 49.2 m-85 -70.52 -33.63 71.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.702 -0.681 . . . . 1.67 111.581 -178.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -70.84 -24.42 77.05 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.188 -0.53 . . . . 0.78 113.367 -175.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 38.5 t70 -74.19 -4.24 34.72 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.206 0.527 . . . . 1.9 111.061 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 22.4 m -86.33 -13.79 45.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.011 0.434 . . . . 1.44 110.202 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.692 ' HB ' ' HA3' ' A' ' 98' ' ' GLY . 27.5 mt -80.44 69.33 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.551 0.691 . . . . 2.91 109.764 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 10.8 p30 -131.29 179.25 6.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.384 -0.825 . . . . 4.29 109.982 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 1017 ' ' ARG . . . . . 0.414 ' HD2' ' CG ' ' A' ' 154' ' ' LEU . 75.8 mtp180 -95.33 94.63 7.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.875 0.369 . . . . 8.17 110.351 -179.256 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.607 0 CA-C-N 116.415 -0.357 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.885 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.7 ptp . . . . . 0 N--CA 1.483 1.21 0 CA-C-O 120.897 0.38 . . . . 6.21 110.707 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.516 ' HB3' ' OD1' ' A' ' 135' ' ' ASN . 49.4 m -81.54 12.21 3.96 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.141 -0.482 . . . . 1.87 111.862 -177.185 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.646 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 26.8 mp0 -100.36 -22.53 15.04 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.61 -0.268 . . . . 2.42 110.985 177.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.604 ' O ' HD13 ' A' ' 8' ' ' LEU . 19.3 m -72.45 -23.66 61.09 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 111.683 0.253 . . . . 1.25 111.683 -174.326 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.943 ' HA ' HD22 ' A' ' 8' ' ' LEU . 6.3 p30 -65.16 -22.43 66.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.763 0.316 . . . . 1.78 110.434 175.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.646 ' HB2' ' O ' ' A' ' 3' ' ' GLN . 0.6 OUTLIER -58.55 -53.15 61.59 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 115.949 -0.569 . . . . 1.4 110.133 173.89 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -56.23 -49.11 75.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.184 -0.916 . . . . 0.68 110.733 -178.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.943 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.6 OUTLIER -47.49 -44.19 25.2 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.499 -0.773 . . . . 1.16 111.056 176.385 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.529 HG13 ' HE2' ' A' ' 130' ' ' MET . 72.9 t -70.79 -64.05 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.296 0.57 . . . . 0.27 110.548 175.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.593 HG23 ' O ' ' A' ' 6' ' ' ARG . 48.8 t -51.83 -48.49 38.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 114.906 -1.043 . . . . 0.33 112.676 -174.325 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -56.03 -38.06 70.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.291 -0.413 . . . . 0.59 110.679 -178.004 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.646 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 47.6 t80 -74.33 -45.01 50.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.136 -0.483 . . . . 1.61 110.964 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.726 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.8 mp -57.67 -44.06 85.49 Favored 'General case' 0 C--N 1.338 0.083 0 C-N-CA 120.386 -0.525 . . . . 0.34 109.846 178.514 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 m -58.48 -40.47 82.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.47 0.652 . . . . 1.05 110.675 177.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -73.67 -17.99 61.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.299 -0.864 . . . . 1.22 111.215 -174.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.668 ' HE2' ' HA ' ' A' ' 16' ' ' LYS . 10.0 mmpt? -88.52 -47.75 8.09 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-O 121.5 0.667 . . . . 1.41 110.32 -178.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.6 HD21 ' SG ' ' A' ' 111' ' ' CYS . 13.4 mt -57.41 -30.8 65.25 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 115.258 -0.883 . . . . 1.35 111.335 177.492 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.5 t -57.24 -47.78 80.49 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.112 -0.495 . . . . 0.94 111.409 177.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -74.14 1.4 11.29 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.931 0.396 . . . . 1.37 111.854 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.627 ' HE2' HG11 ' A' ' 112' ' ' VAL . 15.3 mmmt -110.49 -26.74 9.34 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.953 0.883 . . . . 2.2 109.172 178.328 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.72 26.3 7.23 Favored Glycine 0 N--CA 1.443 -0.833 0 CA-C-N 114.014 -1.448 . . . . 0.53 111.921 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -122.59 167.19 13.7 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.851 0.358 . . . . 0.76 110.831 174.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.9 t -110.55 151.19 27.9 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.897 -0.592 . . . . 0.52 110.003 177.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -72.67 -51.1 20.85 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.08 -0.509 . . . . 3.36 109.759 172.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.1 p -61.72 -40.61 95.69 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.68 -0.691 . . . . 1.37 111.596 -171.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -55.74 -31.0 62.15 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.103 0.478 . . . . 1.11 111.33 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.409 ' O ' ' HB2' ' A' ' 124' ' ' SER . 67.1 m-85 -114.14 16.05 18.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.937 -0.574 . . . . 1.28 111.125 -176.19 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.619 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 59.8 p -100.97 -179.68 4.12 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.739 0.781 . . . . 1.81 112.359 -175.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.58 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 6.9 t70 -163.91 -24.44 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 113.934 -1.485 . . . . 2.31 108.142 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.926 HG23 ' H ' ' A' ' 31' ' ' GLU . 9.9 m -57.91 -72.88 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 113.884 -1.507 . . . . 0.92 112.874 -177.232 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.926 ' H ' HG23 ' A' ' 30' ' ' VAL . 14.5 mm-40 -86.59 -0.05 55.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.543 -0.91 . . . . 2.74 108.543 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.58 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.1 tt0 -73.3 -58.25 3.44 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.663 -1.153 . . . . 1.45 110.182 178.575 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -81.85 -51.55 8.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.712 -0.676 . . . . 1.87 110.827 -176.017 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.6 ptp180 -102.5 144.42 30.97 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.228 0.537 . . . . 3.39 110.41 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 14.8 p -129.83 110.95 12.13 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.633 -0.712 . . . . 2.25 109.953 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -122.38 -67.33 0.96 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.714 -0.676 . . . . 3.34 111.046 -173.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.444 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . . . -63.33 137.38 97.06 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.736 -0.665 . . . . 1.92 111.491 179.069 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.735 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 50.6 Cg_exo -58.48 -178.09 0.11 Allowed 'Trans proline' 0 CA--C 1.529 0.227 0 C-N-CA 123.41 2.74 . . . . 1.87 112.022 173.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -74.36 -11.38 60.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.22 0.533 . . . . 4.64 110.361 178.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 160.54 70.97 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.883 0 N-CA-C 111.115 -0.794 . . . . 2.15 111.115 178.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.821 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.5 t -71.9 -74.66 0.15 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 120.78 -0.368 . . . . 1.12 110.586 -174.103 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.821 ' H ' HG23 ' A' ' 41' ' ' THR . 12.8 pt-20 -93.1 -29.99 15.49 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 122.545 1.164 . . . . 2.02 108.692 168.438 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.702 ' HA ' HG13 ' A' ' 46' ' ' VAL . 3.7 p -60.06 -27.13 66.71 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 112.717 -2.038 . . . . 1.25 113.599 -170.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -46.17 -54.15 9.2 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 111.8 0.296 . . . . 1.91 111.8 -176.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.99 -41.76 61.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.555 0.217 . . . . 0.52 111.521 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.702 HG13 ' HA ' ' A' ' 43' ' ' SER . 0.5 OUTLIER -70.19 -37.15 70.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.896 -0.322 . . . . 1.41 111.29 -174.787 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.568 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 8.4 ptpt -68.12 -36.38 79.63 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.4 -0.963 . . . . 0.67 108.4 176.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.498 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 16.0 mm-40 -63.79 -38.84 92.61 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.195 -0.911 . . . . 0.99 110.619 178.399 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.689 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -74.0 -41.38 61.97 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.183 0.516 . . . . 0.42 110.632 176.586 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.45 HD22 ' HA ' ' A' ' 50' ' ' LEU . 0.1 OUTLIER -54.6 -43.53 72.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.092 -0.958 . . . . 1.33 111.687 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.568 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 7.9 ptp180 -74.58 -26.16 59.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.179 0.514 . . . . 2.17 110.026 -170.214 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.498 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 5.3 mm-40 -74.17 -51.46 15.44 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.898 -1.046 . . . . 1.1 110.077 178.056 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.32 -42.13 99.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.517 -0.765 . . . . 0.53 110.19 177.075 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.613 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -64.74 -38.29 95.43 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.584 -0.735 . . . . 0.7 111.95 176.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.431 ' HA ' ' OE2' ' A' ' 58' ' ' GLU . 14.7 t70 -57.59 -54.14 50.2 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 122.337 0.255 . . . . 1.04 110.496 177.039 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.538 ' HA ' HD11 ' A' ' 59' ' ' LEU . 48.0 mt-10 -56.99 -27.72 61.72 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 123.847 0.717 . . . . 2.29 111.569 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.452 ' CD1' HD11 ' B' 1015 ' ' ILE . 75.2 t80 -72.98 -30.67 63.98 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.929 -0.578 . . . . 2.29 110.921 177.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 41.0 mt-10 -70.47 -70.27 0.31 Allowed 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 112.18 0.437 . . . . 1.3 112.18 -173.652 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.674 HD22 ' N ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -55.6 -34.52 64.93 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.083 0.468 . . . . 1.54 111.457 -174.661 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.674 ' N ' HD22 ' A' ' 59' ' ' LEU . 7.3 ttm180 -53.04 -66.39 0.39 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.337 -0.847 . . . . 2.58 111.676 176.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -94.22 -0.23 55.27 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.161 0.8 . . . . 5.32 113.161 -172.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.479 ' HA ' ' CD2' ' A' ' 65' ' ' PHE . 3.0 tmt_? -43.69 -38.41 3.11 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.38 0.672 . . . . 4.48 112.272 -176.272 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 67.1 mtt180 -46.39 -50.36 16.68 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.111 0.481 . . . . 4.72 110.551 176.374 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.453 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -71.91 -47.76 50.34 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 115.609 -0.723 . . . . 1.17 110.854 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.479 ' CD2' ' HA ' ' A' ' 62' ' ' ARG . 17.9 m-85 -45.9 -48.65 16.12 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.905 0.706 . . . . 2.81 112.905 -172.719 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.412 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 27.8 t -62.46 -38.28 89.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.111 0.481 . . . . 2.19 110.894 -177.262 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -81.21 -31.58 33.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.183 0.516 . . . . 2.72 110.479 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 64' ' ' ALA . 1.8 mp -60.64 -17.66 48.65 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.309 -0.859 . . . . 1.56 112.296 -177.225 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.73 HG22 HG13 ' A' ' 74' ' ' ILE . 3.4 p -55.83 -25.43 41.79 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.165 0.439 . . . . 0.7 110.926 177.493 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.5 t -74.35 -37.24 63.56 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.266 0.555 . . . . 1.34 109.535 175.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -72.36 -40.89 67.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.321 -0.854 . . . . 1.42 110.37 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.432 ' O ' ' HB3' ' A' ' 73' ' ' HIS . 3.1 mm? -68.25 -34.31 75.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.641 -0.503 . . . . 1.37 109.641 170.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.432 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 85.9 t60 71.11 0.76 3.54 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.586 -0.734 . . . . 2.72 109.844 -171.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.73 HG13 HG22 ' A' ' 69' ' ' THR . 31.6 mm 20.12 -85.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 126.0 1.72 . . . . 0.91 114.256 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.891 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER 23.14 -160.87 0.0 OUTLIER Pre-proline 0 CA--C 1.588 2.423 0 C-N-CA 125.033 1.333 . . . . 0.51 113.513 -173.927 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.891 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 76.2 Cg_exo -28.13 165.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 125.267 3.978 . . . . 0.47 117.281 169.266 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -34.68 -20.9 0.01 OUTLIER Glycine 0 C--N 1.347 1.153 0 N-CA-C 117.627 1.811 . . . . 0.4 117.627 -173.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.438 ' N ' ' O ' ' A' ' 76' ' ' PRO . 38.2 p -66.69 0.91 2.04 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 117.97 0.885 . . . . 0.56 111.481 178.559 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.512 ' HB2' ' O ' ' A' ' 74' ' ' ILE . . . -67.91 -14.72 63.19 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.987 -0.552 . . . . 0.34 110.272 172.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -78.31 -21.01 50.29 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.367 -0.605 . . . . 4.13 109.367 176.445 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.544 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 41.9 mt-30 -81.86 -25.87 34.71 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.006 0.908 . . . . 1.03 109.387 172.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.488 ' OG ' ' HA ' ' A' ' 79' ' ' ALA . 2.3 m -72.23 -54.22 10.26 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.344 -1.298 . . . . 0.48 109.743 173.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.48 ' HE2' ' CE1' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -62.41 -19.5 63.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.887 -1.051 . . . . 1.18 110.213 176.21 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.602 ' HA ' HG12 ' A' ' 87' ' ' VAL . 37.2 tt0 -63.39 -51.6 65.17 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.043 -0.981 . . . . 0.8 111.027 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -50.03 -33.05 16.94 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.076 -0.965 . . . . 1.62 110.82 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.686 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -83.13 -51.65 14.19 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.04 0 CA-C-N 114.605 -1.179 . . . . 1.3 110.725 -177.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.602 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.8 p -61.64 -22.38 28.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.888 0.851 . . . . 0.85 109.378 -178.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.577 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.7 m-80 -68.07 -51.72 43.35 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 114.142 -1.39 . . . . 0.91 110.912 173.499 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.976 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.9 OUTLIER -65.45 -37.31 86.5 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 121.763 0.792 . . . . 2.87 108.872 -178.932 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.624 ' HG ' ' CD ' ' A' ' 89' ' ' GLU . 21.1 mt -67.17 -19.22 65.55 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 113.907 -1.497 . . . . 1.28 112.591 -167.332 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.735 ' HA ' HG22 ' A' ' 95' ' ' VAL . 2.7 p90 -109.94 -19.7 13.01 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.78 -0.368 . . . . 2.3 111.878 -174.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.577 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.0 OUTLIER -100.98 -22.53 14.74 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.255 -0.578 . . . . 5.06 111.253 -177.984 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -96.15 21.19 9.18 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.822 -0.626 . . . . 3.12 111.345 -169.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 112.82 67.62 0.51 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 118.291 -1.909 . . . . 2.31 114.059 175.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.735 HG22 ' HA ' ' A' ' 91' ' ' PHE . 38.8 t -70.33 95.63 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.465 0 CA-C-O 122.67 1.224 . . . . 1.06 110.928 -177.393 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.506 ' OD1' ' HG2' ' A' ' 99' ' ' ARG . 2.5 p30 -110.2 179.21 4.16 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 113.095 -1.866 . . . . 2.12 107.252 167.618 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.606 ' HB3' ' CD2' ' A' ' 151' ' ' PHE . 12.7 m-90 -51.87 -44.06 63.55 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 123.411 0.444 . . . . 3.34 111.529 -176.278 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -62.71 -33.14 85.89 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 114.662 0.625 . . . . 0.69 114.662 -176.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.506 ' HG2' ' OD1' ' A' ' 96' ' ' ASN . 81.5 mmt-85 -60.93 -38.72 86.79 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 117.632 0.716 . . . . 4.24 110.38 -178.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.595 HG12 ' HG ' ' A' ' 138' ' ' LEU . 81.4 mt -75.17 -35.4 34.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 115.196 -0.911 . . . . 0.44 111.281 -173.166 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.4 m -65.88 -33.78 65.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.549 -0.537 . . . . 1.35 109.549 173.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.51 -48.04 71.05 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.218 0.532 . . . . 0.44 109.603 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.48 ' CE1' ' HE2' ' A' ' 83' ' ' PHE . 42.8 t80 -50.48 -53.2 31.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.47 -1.241 . . . . 1.49 111.931 178.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.527 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 0.2 OUTLIER -80.08 -20.23 45.63 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.395 -0.522 . . . . 3.29 111.081 -175.027 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.646 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 31.3 t -75.01 -53.02 9.65 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.63 0.252 . . . . 1.19 110.382 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.521 ' CZ ' ' HB ' ' A' ' 86' ' ' VAL . 2.3 p90 -68.23 -22.08 64.8 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 109.599 -0.519 . . . . 2.89 109.599 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.464 ' HA2' ' HB2' ' A' ' 110' ' ' LEU . . . -75.07 -40.87 33.67 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.687 -0.768 . . . . 0.3 111.507 174.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.726 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -64.57 -33.98 88.69 Favored Glycine 0 N--CA 1.448 -0.5 0 N-CA-C 110.916 -0.874 . . . . 0.23 110.916 174.246 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.95 -29.23 58.22 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.532 -0.334 . . . . 0.31 110.449 173.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.464 ' HB2' ' HA2' ' A' ' 107' ' ' GLY . 0.2 OUTLIER -62.73 -39.67 94.79 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 107.758 -1.201 . . . . 1.12 107.758 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.727 ' SG ' HG22 ' A' ' 123' ' ' VAL . 41.1 t -48.69 -60.32 2.82 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 113.362 -1.744 . . . . 0.26 109.554 171.86 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.924 ' HA ' HG13 ' A' ' 115' ' ' VAL . 46.0 t -66.38 -31.65 54.54 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 CA-C-N 116.366 -0.379 . . . . 0.35 111.859 -178.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.533 ' O ' HG21 ' A' ' 74' ' ' ILE . 22.5 mt-10 -57.52 -20.72 33.42 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 118.28 0.491 . . . . 2.51 110.321 176.292 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.519 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 50.1 m -89.54 -44.93 9.76 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 108.465 -0.939 . . . . 0.28 108.465 179.578 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.924 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.4 m -67.86 -29.07 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.106 0 CA-C-N 115.061 -0.972 . . . . 1.23 109.623 -177.069 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -51.56 -50.62 59.73 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 113.379 -1.737 . . . . 0.6 111.169 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt -86.15 13.57 7.65 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.695 -0.684 . . . . 1.62 109.811 178.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.423 ' HA ' ' OE1' ' A' ' 120' ' ' GLN . 23.9 mm-40 63.57 53.54 2.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 122.016 0.912 . . . . 1.88 110.571 -177.629 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.554 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 27.1 mtm -132.27 39.83 3.37 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.197 -1.365 . . . . 0.31 107.457 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.661 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 0.0 OUTLIER -53.54 -6.82 0.08 Allowed 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 114.685 -1.143 . . . . 1.15 113.18 -178.542 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.563 HG23 HD22 ' A' ' 122' ' ' LEU . 21.1 m -67.71 -29.01 43.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.588 -0.695 . . . . 0.46 111.973 175.608 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.563 HD22 HG23 ' A' ' 121' ' ' VAL . 3.8 mm? -65.06 -27.27 68.67 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.02 0.438 . . . . 0.26 110.294 178.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.727 HG22 ' SG ' ' A' ' 111' ' ' CYS . 39.8 t -44.13 -46.4 2.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 114.384 -1.28 . . . . 0.25 112.165 -177.109 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.619 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 23.0 t -73.83 -43.28 59.22 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.325 -0.398 . . . . 1.35 111.743 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.452 ' HD3' HD12 ' A' ' 122' ' ' LEU . 8.6 ptm180 -72.24 -36.87 69.19 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.966 -0.293 . . . . 2.67 110.264 -170.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.577 HD12 ' HA ' ' A' ' 111' ' ' CYS . 82.4 mt -55.45 -49.58 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.642 -0.254 . . . . 0.23 111.323 174.759 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.563 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.2 -30.5 66.51 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.767 0.318 . . . . 0.29 111.478 -178.447 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.09 -60.66 3.28 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.395 0.617 . . . . 0.28 110.193 175.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.416 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 98.5 m95 -57.75 -41.8 82.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.648 -1.16 . . . . 3.91 111.045 -178.071 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.529 ' HE2' HG13 ' A' ' 9' ' ' VAL . 87.5 mtp -59.11 -57.74 11.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.457 -0.338 . . . . 1.08 111.416 -178.247 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.1 74.87 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.872 -0.331 . . . . 0.25 110.87 -177.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.421 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 22.4 m -68.02 -45.18 74.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.852 0.358 . . . . 0.4 111.458 176.744 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.61 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 13.0 m-85 -63.78 -33.29 75.33 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.896 -0.321 . . . . 3.13 110.422 177.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.819 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.7 tt -64.43 -50.95 65.58 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 108.354 -0.98 . . . . 0.95 108.354 170.079 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ASN . . . . . 0.516 ' OD1' ' HB3' ' A' ' 2' ' ' SER . 2.3 m-80 -49.02 -60.83 2.44 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.651 0.611 . . . . 0.46 112.651 -179.366 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -78.51 -44.91 23.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.931 0.396 . . . . 0.59 111.941 -172.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' HIS . . . . . 0.61 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 14.5 m80 -90.54 -51.41 5.41 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.857 0.688 . . . . 1.45 112.857 -170.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.819 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -85.37 -47.07 10.35 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 113.932 1.086 . . . . 1.2 113.932 -168.844 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.694 ' HA ' HD12 ' A' ' 142' ' ' ILE . 37.7 tt0 -45.48 -52.72 21.56 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 112.891 0.7 . . . . 0.75 112.891 -173.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.596 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 51.5 Cg_exo -53.44 -48.97 19.08 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.717 1.612 . . . . 0.56 111.522 177.023 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -61.26 -46.1 91.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.332 -0.849 . . . . 1.2 110.339 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.694 HD12 ' HA ' ' A' ' 139' ' ' GLU . 37.5 mt -48.46 -51.25 11.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.073 0.464 . . . . 0.32 111.117 175.264 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.595 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 74.7 mm-40 -59.14 -32.92 70.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.453 -0.794 . . . . 0.57 111.485 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 12.3 mm-40 -64.59 -21.13 66.62 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.585 0.707 . . . . 0.78 110.871 177.48 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -106.76 11.86 29.75 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.0 -1.0 . . . . 0.93 109.54 -175.396 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 113.62 -35.02 4.73 Favored Glycine 0 N--CA 1.439 -1.122 0 CA-C-N 114.525 -1.216 . . . . 0.56 112.895 174.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 124.46 -170.86 16.57 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.664 -0.779 . . . . 0.49 111.691 -177.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.542 ' NE1' HD13 ' A' ' 142' ' ' ILE . 4.4 m-90 -78.54 -33.46 47.84 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.565 0.221 . . . . 3.57 111.099 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -65.28 -41.71 93.88 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.922 0.391 . . . . 1.96 110.309 178.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.462 ' O ' ' HB2' ' A' ' 153' ' ' GLU . 88.2 m -56.94 -35.85 69.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.868 -0.605 . . . . 0.67 111.197 177.085 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.606 ' CD2' ' HB3' ' A' ' 97' ' ' TRP . 53.5 t80 -58.92 -41.97 88.58 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.216 -0.447 . . . . 3.0 110.552 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.522 HG12 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -72.81 -25.75 22.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.098 0.475 . . . . 1.15 110.304 -179.039 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 150' ' ' THR . 62.0 mm-40 -60.81 -23.21 64.88 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.033 0.444 . . . . 1.67 110.551 173.272 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.525 ' HB2' ' CD1' ' A' ' 155' ' ' TYR . 0.5 OUTLIER -105.5 -54.27 2.51 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.887 -0.597 . . . . 1.3 110.956 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 155' ' ' TYR . . . . . 0.525 ' CD1' ' HB2' ' A' ' 154' ' ' LEU . 88.8 m-85 -110.61 14.51 22.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.643 -0.708 . . . . 4.24 111.242 -171.153 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.689 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -59.76 158.93 23.2 Favored Glycine 0 CA--C 1.504 -0.643 0 C-N-CA 121.251 -0.5 . . . . 1.1 113.629 -175.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -48.73 108.87 0.2 Allowed 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 113.94 -1.13 . . . . 1.29 110.947 178.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.692 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 3.9 m120 -76.26 -26.49 56.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.382 -0.372 . . . . 2.99 111.912 -174.538 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -55.08 -48.15 73.92 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.895 0.378 . . . . 2.52 110.743 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -75.0 -37.01 61.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.099 -0.5 . . . . 2.87 110.788 176.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.527 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -58.25 -56.2 25.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.969 -0.56 . . . . 3.2 111.596 -178.148 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.692 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 10.6 pt-20 -66.22 -25.22 66.81 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.53 0.205 . . . . 3.72 111.218 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.4 t -68.37 -47.31 67.72 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 109.605 -0.517 . . . . 4.18 109.605 -179.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' ARG . . . . . 0.413 ' HD2' ' HA ' ' A' ' 164' ' ' ARG . 0.8 OUTLIER -77.86 -17.74 57.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.501 0.667 . . . . 5.82 110.276 177.79 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.506 ' HB3' ' HA ' ' A' ' 162' ' ' GLU . 41.3 ttmt -76.87 -37.78 54.92 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.209 -0.905 . . . . 4.77 109.796 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -62.71 -39.19 97.63 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.317 -0.856 . . . . 5.1 112.617 -178.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -74.63 -23.19 58.65 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 122.496 -0.414 . . . . 5.72 110.387 178.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -74.23 -13.98 60.86 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.766 -0.652 . . . . 5.88 109.362 175.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.524 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 4.2 tmt_? -92.05 -29.3 16.65 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.201 -0.909 . . . . 7.34 108.686 178.655 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.444 HD22 ' HA ' ' A' ' 170' ' ' LEU . 0.3 OUTLIER -87.83 -59.54 2.22 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.442 -0.799 . . . . 6.97 109.401 -174.53 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -83.04 124.27 30.27 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.081 -0.711 . . . . 6.97 109.081 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -96.32 117.75 31.46 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.861 0.362 . . . . 9.35 110.301 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -75.43 -5.67 46.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.833 -0.621 . . . . 11.4 112.062 -174.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -75.88 96.42 3.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.898 0.38 . . . . 11.52 110.399 177.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -101.47 -41.44 6.63 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.285 -0.635 . . . . 14.48 109.285 175.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -170.16 -77.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.504 -0.771 . . . . 15.37 109.769 175.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 177' ' ' HIS . . . . . 0.449 ' HB3' HD23 ' A' ' 178' ' ' LEU . 26.5 m170 45.1 -100.96 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.692 0.62 . . . . 16.02 112.218 -177.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.451 ' H ' HD23 ' A' ' 178' ' ' LEU . 2.5 pt? -137.28 152.32 49.66 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.963 -0.384 . . . . 17.99 109.963 -179.066 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -110.72 153.93 24.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.0 -0.545 . . . . 19.19 110.656 -177.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -80.58 150.68 29.45 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.551 -0.537 . . . . 22.26 109.551 178.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -87.87 122.06 31.04 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.042 0.448 . . . . 22.51 110.864 -178.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 42.4 t-80 -96.56 -12.1 24.49 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.646 -0.707 . . . . 24.89 109.585 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -80.03 126.79 31.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.718 -0.674 . . . . 25.58 109.746 174.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 21.9 t60 -91.72 -20.58 21.41 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.047 0.451 . . . . 27.37 109.922 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 40.7 m80 . . . . . 0 C--O 1.247 0.946 0 CA-C-O 118.455 -0.783 . . . . 29.06 110.015 179.132 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.291 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . 72.68 54.05 7.79 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.873 -0.679 . . . . 2.97 111.545 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.467 ' HA ' ' HB2' ' B' 1006 ' ' ARG . 25.4 m -125.9 -149.52 0.42 Allowed 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 110.379 -0.23 . . . . 1.94 110.379 -177.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.96 HG23 ' H ' ' B' 1005 ' ' GLY . 14.8 m 52.63 -92.87 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 124.548 1.139 . . . . 1.63 112.571 174.6 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 1005 ' ' GLY . . . . . 0.96 ' H ' HG23 ' B' 1004 ' ' VAL . . . -46.23 -25.39 1.87 Allowed Glycine 0 CA--C 1.532 1.14 0 CA-C-N 119.914 1.234 . . . . 1.2 113.037 165.421 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 1006 ' ' ARG . . . . . 0.467 ' HB2' ' HA ' ' B' 1003 ' ' CYS . 10.3 mpt_? -85.32 -47.8 9.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.103 0.478 . . . . 2.88 111.165 171.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 1007 ' ' ALA . . . . . 0.645 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -82.68 -52.74 6.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.829 -0.623 . . . . 1.31 112.543 -168.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.646 HD23 ' HA ' ' B' 1004 ' ' VAL . 3.9 mm? -59.58 -58.56 8.04 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 123.172 0.295 . . . . 1.33 110.542 -176.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 1009 ' ' ALA . . . . . 0.976 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -32.35 -53.63 0.31 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 122.186 0.993 . . . . 0.88 112.059 170.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.832 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -68.69 -55.19 12.23 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 113.816 -1.538 . . . . 1.03 111.877 -176.199 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.605 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 48.9 m-85 -64.7 -23.27 67.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.199 -0.455 . . . . 1.67 111.048 -178.338 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 1012 ' ' GLY . . . . . 0.465 ' O ' HD13 ' B' 1015 ' ' ILE . . . -72.19 -6.66 65.39 Favored Glycine 0 N--CA 1.446 -0.669 0 CA-C-N 116.006 -0.543 . . . . 0.78 112.831 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -80.87 -2.26 46.69 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 111.757 0.28 . . . . 1.9 111.757 177.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 2.4 m -112.32 24.11 12.91 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 121.793 -0.567 . . . . 1.44 111.419 -174.03 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.465 HD13 ' O ' ' B' 1012 ' ' GLY . 1.7 mp -76.26 104.56 4.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.925 0.393 . . . . 2.91 111.243 -178.428 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 1016 ' ' ASN . . . . . 0.413 ' HB3' ' HE2' ' A' ' 155' ' ' TYR . 24.3 t-20 57.64 88.19 0.06 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.224 -0.898 . . . . 4.29 112.086 172.016 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -153.06 -78.29 0.11 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.034 -0.53 . . . . 8.17 110.419 179.497 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 116.611 -0.268 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.832 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.5 ttp . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 120.963 0.411 . . . . 6.21 110.039 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.8 m -99.61 113.0 25.15 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.241 0.543 . . . . 1.87 110.596 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.63 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 43.7 tp60 -71.84 -7.18 46.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.264 0.554 . . . . 2.42 109.69 178.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.793 ' HB3' ' HB3' ' A' ' 38' ' ' PRO . 63.5 p -76.33 -16.21 59.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.805 -0.634 . . . . 1.25 110.249 177.726 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.814 ' HB3' HD13 ' A' ' 134' ' ' LEU . 51.5 m-20 -66.81 -19.82 65.82 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.462 -0.57 . . . . 1.78 109.462 175.205 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.63 ' HB2' ' O ' ' A' ' 3' ' ' GLN . 2.5 mmt85 -51.01 -51.02 57.22 Favored 'General case' 0 CA--C 1.509 -0.607 0 CA-C-N 115.417 -0.811 . . . . 1.4 110.522 176.257 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.438 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 43.5 mt-10 -56.38 -47.2 79.42 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.172 -0.922 . . . . 0.68 111.163 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.764 HD22 ' HA ' ' A' ' 5' ' ' ASN . 1.2 mp -51.44 -31.58 23.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.508 -0.769 . . . . 1.16 111.21 176.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.454 HG21 ' CA ' ' A' ' 131' ' ' ALA . 77.9 t -83.1 -67.05 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.55 0.691 . . . . 0.27 110.531 172.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 6' ' ' ARG . 51.1 t -50.28 -55.26 6.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.656 -1.156 . . . . 0.33 113.515 -172.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -50.73 -33.33 22.55 Favored 'General case' 0 C--O 1.234 0.246 0 O-C-N 123.635 0.584 . . . . 0.59 111.364 -174.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.651 ' HE1' ' HB3' ' A' ' 51' ' ' ARG . 98.9 m-85 -90.37 -35.57 15.12 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.838 -0.619 . . . . 1.61 112.37 -175.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 1.053 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 2.6 mp -60.12 -37.57 80.41 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 119.368 -0.933 . . . . 0.34 108.93 174.037 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.452 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 39.8 t -58.75 -44.98 90.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.278 -0.873 . . . . 1.05 110.68 175.134 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -66.9 -33.92 76.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.072 -0.513 . . . . 1.22 110.702 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.63 ' HG2' ' O ' ' A' ' 12' ' ' PHE . 8.5 mmpt? -68.97 -33.24 73.37 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.434 -0.348 . . . . 1.41 110.962 -178.495 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.628 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -73.2 -30.02 63.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.876 0.37 . . . . 1.35 110.434 176.447 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.6 t -62.44 -36.15 81.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.911 -0.586 . . . . 0.94 111.4 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -77.07 -1.91 31.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 1.37 111.664 -179.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.594 ' HE2' HG11 ' A' ' 112' ' ' VAL . 15.6 mmmt -111.75 -26.21 9.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.872 0.844 . . . . 2.2 109.227 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.69 23.14 8.96 Favored Glycine 0 N--CA 1.441 -0.982 0 CA-C-N 113.978 -1.465 . . . . 0.53 111.719 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.484 ' HE2' HE21 ' A' ' 120' ' ' GLN . 50.0 m-85 -113.66 164.69 13.36 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.023 -0.362 . . . . 0.76 110.023 175.526 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.607 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 2.1 t -111.57 143.68 42.06 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.975 -0.557 . . . . 0.52 109.833 176.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.452 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.8 OUTLIER -66.5 -48.75 68.82 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.229 -0.441 . . . . 3.36 110.117 174.631 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.484 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 3.9 p -64.36 -27.84 69.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.5 . . . . 1.37 111.919 -174.237 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.607 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 94.7 mt-30 -57.36 -33.65 68.01 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.203 0.525 . . . . 1.11 110.989 176.006 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.411 ' O ' ' HB2' ' A' ' 124' ' ' SER . 62.3 m-85 -120.09 14.86 12.34 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.604 -0.726 . . . . 1.28 111.319 -170.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.579 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 72.5 p -100.98 179.89 4.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 122.074 0.94 . . . . 1.81 112.94 -172.288 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.598 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 21.4 t70 -168.69 -20.28 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 113.182 -1.827 . . . . 2.31 107.933 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.884 HG23 ' H ' ' A' ' 31' ' ' GLU . 5.8 m -57.51 -71.8 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 114.171 -1.377 . . . . 0.92 112.669 -176.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.884 ' H ' HG23 ' A' ' 30' ' ' VAL . 24.2 mm-40 -87.82 -2.92 58.92 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.668 -0.864 . . . . 2.74 108.668 177.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.598 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 34.6 tt0 -76.27 -41.18 49.71 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.6 -1.182 . . . . 1.45 109.378 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -135.8 90.21 2.57 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.218 -0.901 . . . . 1.87 109.341 177.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.543 ' HB3' ' O ' ' A' ' 30' ' ' VAL . 10.2 ptm180 -147.24 -174.87 4.63 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-O 121.753 0.787 . . . . 3.39 112.526 -175.564 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.1 p -67.54 -179.91 1.19 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.045 -1.434 . . . . 2.25 112.187 174.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.502 ' HG3' ' H ' ' A' ' 37' ' ' ALA . 6.0 pt-20 -77.03 -111.57 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.212 -1.358 . . . . 3.34 112.343 -178.495 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.502 ' H ' ' HG3' ' A' ' 36' ' ' GLU . . . -97.99 150.04 36.34 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-N 114.996 -1.002 . . . . 1.92 112.283 -172.67 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.793 ' HB3' ' HB3' ' A' ' 4' ' ' SER . 24.1 Cg_exo -64.15 159.55 42.53 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 123.455 2.77 . . . . 1.87 112.299 171.253 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -87.45 6.56 33.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.782 0.801 . . . . 4.64 109.833 173.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.562 ' O ' ' HG2' ' A' ' 42' ' ' GLU . . . -173.63 71.84 0.1 OUTLIER Glycine 0 N--CA 1.445 -0.749 0 CA-C-N 114.885 -1.052 . . . . 2.15 110.582 -176.025 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.638 HG22 ' HB2' ' A' ' 38' ' ' PRO . 1.5 p -72.79 13.91 0.33 Allowed 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 123.959 0.904 . . . . 1.12 113.19 -172.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.562 ' HG2' ' O ' ' A' ' 40' ' ' GLY . 10.4 pt-20 -29.3 -32.55 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.713 1.205 . . . . 2.02 113.454 169.431 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.724 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 2.7 p -30.74 -49.03 0.12 Allowed 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 114.228 1.196 . . . . 1.25 114.228 -177.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -40.27 -50.93 2.76 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.748 0.648 . . . . 1.91 112.748 -173.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.39 -36.38 58.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.697 0.284 . . . . 0.52 111.519 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.577 ' HA ' HG12 ' A' ' 152' ' ' VAL . 1.0 OUTLIER -74.25 -39.05 49.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.632 -0.258 . . . . 1.41 111.344 -175.011 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.724 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.0 ptpt -67.37 -44.43 78.97 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.993 -0.743 . . . . 0.67 108.993 174.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.429 ' N ' ' HG3' ' A' ' 47' ' ' LYS . 16.1 mm-40 -54.12 -35.18 61.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.724 -0.671 . . . . 0.99 112.038 174.133 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.627 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -80.66 -30.94 36.52 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.105 0.479 . . . . 0.42 111.036 177.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.612 ' HG ' ' CE2' ' A' ' 104' ' ' PHE . 1.1 mp -68.34 -26.92 65.84 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.707 -0.679 . . . . 1.33 111.744 -176.586 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.651 ' HB3' ' HE1' ' A' ' 12' ' ' PHE . 5.3 ptp180 -80.83 -26.6 36.95 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.57 0.7 . . . . 2.17 109.26 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -71.5 -54.33 10.92 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.592 -1.186 . . . . 1.1 109.707 177.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.36 -39.31 93.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.724 -0.671 . . . . 0.53 110.454 176.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.701 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -58.22 -51.92 55.66 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.666 -0.697 . . . . 0.7 112.003 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.552 ' O ' HD22 ' A' ' 59' ' ' LEU . 17.8 t70 -53.33 -40.89 65.2 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.956 0.408 . . . . 1.04 111.226 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.523 ' O ' HD21 ' A' ' 59' ' ' LEU . 44.2 mt-10 -75.27 -25.34 57.93 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.453 -0.794 . . . . 2.29 111.645 -179.018 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.902 ' HZ ' ' HA2' ' B' 1012 ' ' GLY . 8.0 t80 -85.38 -46.95 10.46 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.74 0.644 . . . . 2.29 112.74 178.456 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.701 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 44.8 mt-10 -54.86 -52.12 63.81 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.737 0.643 . . . . 1.3 112.737 -166.296 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.581 HD23 ' N ' ' A' ' 59' ' ' LEU . 2.2 pt? -52.15 -34.25 43.94 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.196 -0.911 . . . . 1.54 111.697 -174.327 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 -55.35 -55.15 34.81 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.466 -0.334 . . . . 2.58 111.154 -178.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.613 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 47.4 p90 -93.03 -3.58 54.09 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.242 -0.435 . . . . 5.32 111.775 -178.442 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.632 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 41.6 ttm180 -50.87 -36.04 35.78 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.746 0.647 . . . . 4.48 112.746 -173.113 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -61.81 -31.59 71.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.605 0.24 . . . . 4.72 111.512 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.638 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.06 -47.8 7.6 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.567 0.58 . . . . 1.17 112.567 -174.489 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.632 ' CD1' ' HA ' ' A' ' 62' ' ' ARG . 5.7 p90 -58.47 -27.09 64.09 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.703 0.631 . . . . 2.81 112.703 -166.297 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.0 t -70.58 -31.59 68.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.151 0.5 . . . . 2.19 110.259 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -91.01 -24.96 19.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 2.72 111.008 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 59.9 mt -59.76 -16.69 29.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.915 0.709 . . . . 1.56 112.915 -174.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.658 HG22 HG13 ' A' ' 74' ' ' ILE . 16.6 p -50.91 -35.89 35.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.113 0.482 . . . . 0.7 111.113 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 13.4 t -67.01 -34.72 78.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.402 -0.817 . . . . 1.34 110.755 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -78.54 -49.06 13.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.776 -0.647 . . . . 1.42 110.289 -177.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.723 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.1 mt -67.06 -30.64 70.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.397 -0.819 . . . . 1.37 110.196 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.1 m80 68.58 61.31 0.36 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.922 0.868 . . . . 2.72 109.191 -177.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.658 HG13 HG22 ' A' ' 69' ' ' THR . 16.0 mm -64.93 123.54 17.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 114.009 -1.45 . . . . 0.91 110.926 -178.662 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.773 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.1 -169.35 0.22 Allowed Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 107.515 -1.291 . . . . 0.51 107.515 -169.872 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.773 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.5 Cg_exo -30.5 166.26 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.272 0 C-N-CA 124.722 3.614 . . . . 0.47 114.875 164.69 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.24 -28.93 0.01 OUTLIER Glycine 0 N--CA 1.476 1.331 0 N-CA-C 117.089 1.596 . . . . 0.4 117.089 -175.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.455 ' N ' ' O ' ' A' ' 76' ' ' PRO . 22.1 p -69.27 6.53 0.97 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 117.693 0.747 . . . . 0.56 111.695 178.222 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.3 -14.23 62.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.391 -0.596 . . . . 0.34 109.391 169.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -75.48 -16.81 60.27 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.649 -0.705 . . . . 4.13 109.348 174.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.491 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 76.5 mt-30 -83.8 -27.01 29.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.947 0.879 . . . . 1.03 109.635 173.489 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.723 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.8 m -72.1 -52.45 16.74 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.646 -1.161 . . . . 0.48 109.187 171.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.438 ' HB2' ' HG ' ' A' ' 110' ' ' LEU . 75.6 t80 -65.03 -16.1 63.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.887 -1.051 . . . . 1.18 110.005 174.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.65 ' HA ' HG12 ' A' ' 87' ' ' VAL . 34.1 tt0 -62.95 -50.14 71.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.975 0.416 . . . . 0.8 110.288 176.247 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -44.32 -45.55 8.8 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 114.793 -1.094 . . . . 1.62 111.343 179.236 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.637 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.4 p -90.44 -39.21 11.79 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 CA-C-N 113.42 -1.718 . . . . 1.3 111.77 -171.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.65 HG12 ' HA ' ' A' ' 84' ' ' GLU . 5.3 p -64.86 -23.4 33.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.894 0.854 . . . . 0.85 109.063 176.718 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.1 m-80 -70.49 -46.09 64.4 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.309 -1.314 . . . . 0.91 111.345 175.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 1.029 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.7 OUTLIER -69.14 -36.4 77.41 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 108.59 -0.893 . . . . 2.87 108.59 -179.222 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.633 HD12 ' HD2' ' A' ' 99' ' ' ARG . 1.1 tp -69.58 -20.16 63.65 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 113.797 -1.547 . . . . 1.28 111.783 -168.671 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.6 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 2.5 p90 -110.66 -12.3 14.34 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.441 -0.503 . . . . 2.3 111.569 -175.474 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.57 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 9.0 ptm180 -98.46 -35.47 10.25 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.388 0.613 . . . . 5.06 110.988 -179.049 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -82.93 5.05 23.24 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.323 -0.853 . . . . 3.12 112.587 -167.125 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 131.26 67.49 0.1 OUTLIER Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 117.83 -2.129 . . . . 2.31 114.724 -177.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.6 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 57.3 t -72.71 95.86 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 122.056 0.931 . . . . 1.06 111.307 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -113.19 -171.0 1.79 Allowed 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.425 -1.261 . . . . 2.12 108.868 173.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.615 ' HB3' ' HE2' ' A' ' 155' ' ' TYR . 15.7 m-90 -53.39 -54.23 39.77 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 123.475 0.484 . . . . 3.34 111.345 -179.544 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.758 ' HA3' HG21 ' B' 1015 ' ' ILE . . . -77.17 -16.59 80.47 Favored Glycine 0 CA--C 1.52 0.381 0 C-N-CA 121.093 -0.575 . . . . 0.69 113.775 -175.334 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.649 HH12 ' HA ' ' B' 1009 ' ' ALA . 7.5 tpp180 -67.36 -43.02 82.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.066 0.46 . . . . 4.24 110.464 -178.683 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.421 ' CD1' ' HG ' ' A' ' 138' ' ' LEU . 85.5 mt -69.86 -31.78 49.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.3 0.572 . . . . 0.44 110.488 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.619 ' HA ' ' CD2' ' A' ' 104' ' ' PHE . 59.8 t -52.96 -51.72 35.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.35 -0.841 . . . . 1.35 110.352 172.42 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.406 ' HB2' ' CE1' ' A' ' 57' ' ' PHE . . . -55.31 -47.61 75.36 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.657 -0.701 . . . . 0.44 110.841 175.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -57.32 -50.71 72.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.315 -0.857 . . . . 1.49 112.357 -178.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.619 ' CD2' ' HA ' ' A' ' 101' ' ' VAL . 1.2 p90 -66.86 -36.18 81.73 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 120.584 -0.446 . . . . 3.29 110.404 -176.035 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 44.5 m -68.4 -40.73 81.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.253 -0.43 . . . . 1.19 110.501 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -71.56 -34.52 70.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.883 -0.599 . . . . 2.89 110.402 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.491 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -62.49 -42.01 99.74 Favored Glycine 0 N--CA 1.444 -0.823 0 C-N-CA 120.367 -0.921 . . . . 0.3 110.89 174.271 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 1.053 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.29 -28.32 73.43 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.788 -0.72 . . . . 0.23 111.683 174.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.97 -35.12 50.59 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.907 -0.172 . . . . 0.31 110.636 176.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.438 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -59.64 -38.81 82.39 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 107.904 -1.146 . . . . 1.12 107.904 178.411 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.781 ' HB2' HD23 ' A' ' 13' ' ' LEU . 26.2 t -49.14 -63.12 1.19 Allowed 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 113.406 -1.725 . . . . 0.26 109.824 171.605 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.94 ' HA ' HG13 ' A' ' 115' ' ' VAL . 42.5 t -62.27 -34.52 64.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 0.35 111.667 -177.314 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.495 ' C ' HG21 ' A' ' 74' ' ' ILE . 32.8 mt-10 -57.0 -23.51 46.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.055 0.455 . . . . 2.51 110.278 178.23 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.419 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 54.3 m -85.93 -43.62 13.07 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 108.479 -0.934 . . . . 0.28 108.479 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.94 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.8 m -69.0 -29.04 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 CA-C-N 114.93 -1.032 . . . . 1.23 109.787 -176.055 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -50.53 -49.93 54.49 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 113.165 -1.834 . . . . 0.6 110.995 174.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -86.81 11.19 13.8 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.554 -0.748 . . . . 1.62 110.019 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 64.03 52.75 1.98 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 122.146 0.974 . . . . 1.88 110.137 -175.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.419 ' CE ' ' HA ' ' A' ' 114' ' ' SER . 30.3 mtm -129.9 36.92 4.0 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.075 -1.42 . . . . 0.31 107.531 179.118 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.78 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 11.7 mp0 -53.84 -7.95 0.15 Allowed 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.637 -1.165 . . . . 1.15 113.24 -178.353 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.51 HG23 HD22 ' A' ' 122' ' ' LEU . 20.9 m -67.06 -20.51 27.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 O-C-N 121.671 -0.643 . . . . 0.46 111.997 175.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.699 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -75.05 -25.07 58.38 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.029 0.442 . . . . 0.26 110.077 177.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.737 HG22 ' SG ' ' A' ' 111' ' ' CYS . 42.3 t -45.52 -51.87 2.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.617 -1.174 . . . . 0.25 112.355 -177.652 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.579 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 7.1 t -75.24 -34.27 61.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.884 0.374 . . . . 1.35 110.76 -178.38 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.699 ' HD2' HD13 ' A' ' 122' ' ' LEU . 74.2 mtt180 -64.06 -51.39 64.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.445 . . . . 2.67 110.591 -176.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.547 HG22 ' SD ' ' A' ' 130' ' ' MET . 73.4 mt -53.97 -50.05 56.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.572 -0.74 . . . . 0.23 111.155 178.73 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -53.73 -36.11 61.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.893 0.378 . . . . 0.29 111.517 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -61.5 -56.99 13.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.555 0.693 . . . . 0.28 110.674 176.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -65.31 -32.01 73.44 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.809 -1.087 . . . . 3.91 111.334 -176.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.547 ' SD ' HG22 ' A' ' 126' ' ' ILE . 90.3 mtp -64.51 -54.29 34.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.907 0.384 . . . . 1.08 111.277 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.454 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -61.69 -41.02 97.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.027 -0.533 . . . . 0.25 111.151 -178.026 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 59.7 m -65.73 -43.24 89.65 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.808 -0.357 . . . . 0.4 110.782 176.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.582 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 16.7 t80 -56.64 -40.11 74.88 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.707 -0.479 . . . . 3.13 109.707 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.865 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.2 tt -61.1 -55.91 27.08 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.827 -0.805 . . . . 0.95 108.827 172.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -50.63 -46.86 58.5 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.388 -0.823 . . . . 0.46 112.862 -176.209 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -87.03 -47.43 8.94 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.127 0.489 . . . . 0.59 111.8 -174.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' HIS . . . . . 0.582 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 66.8 m-70 -90.17 -50.89 5.74 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.829 -0.623 . . . . 1.45 112.253 -170.174 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.865 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -85.07 -44.84 12.66 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 113.555 0.946 . . . . 1.2 113.555 -168.52 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.628 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 29.6 tt0 -45.18 -51.25 25.41 Favored Pre-proline 0 C--N 1.32 -0.701 0 O-C-N 123.699 0.625 . . . . 0.75 112.596 -174.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.581 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 46.5 Cg_exo -55.7 -47.67 24.15 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 121.673 1.582 . . . . 0.56 111.591 175.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' TRP . . . . . 0.439 ' O ' ' HB2' ' A' ' 144' ' ' GLU . 0.1 OUTLIER -57.43 -48.18 79.83 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.507 -0.77 . . . . 1.2 110.387 177.586 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.618 HD12 ' HA ' ' A' ' 139' ' ' GLU . 19.1 mt -51.54 -49.43 33.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.665 -0.698 . . . . 0.32 111.531 175.26 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.628 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 80.5 mm-40 -60.98 -29.71 69.84 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.773 -0.649 . . . . 0.57 111.263 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 13.2 mm-40 -64.57 -20.17 66.08 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 121.439 0.637 . . . . 0.78 110.571 174.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -105.83 3.58 28.84 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.279 -0.873 . . . . 0.93 109.517 -175.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.15 -30.47 6.76 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.157 -0.929 . . . . 0.56 113.229 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' GLY . . . . . 0.423 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 113.42 159.72 13.65 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.252 -0.739 . . . . 0.49 111.252 -175.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.493 ' HB3' ' CB ' ' A' ' 46' ' ' VAL . 81.4 m95 -55.74 -30.77 61.75 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.491 0.552 . . . . 3.57 112.491 -174.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.525 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 14.1 p-10 -63.32 -41.29 98.91 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.669 -0.412 . . . . 1.96 109.955 177.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.543 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 54.3 m -65.94 -32.53 74.08 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.841 -0.618 . . . . 0.67 110.768 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.706 ' HD2' ' HH ' ' A' ' 155' ' ' TYR . 4.1 m-85 -60.28 -41.94 94.4 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.004 -0.544 . . . . 3.0 110.13 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.577 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -77.09 -25.28 15.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.155 0.503 . . . . 1.15 110.233 177.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 8.9 mm-40 -58.74 -20.82 52.68 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 121.967 -0.458 . . . . 1.67 110.124 173.11 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 150' ' ' THR . 2.6 mt -99.36 -55.62 2.63 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.884 -0.598 . . . . 1.3 110.419 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 155' ' ' TYR . . . . . 0.706 ' HH ' ' HD2' ' A' ' 151' ' ' PHE . 26.8 p90 -121.89 30.24 6.74 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.626 0.727 . . . . 4.24 112.402 -173.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.627 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -66.52 163.58 42.96 Favored Glycine 0 C--N 1.303 -1.291 0 CA-C-N 114.804 -1.089 . . . . 1.1 113.738 -177.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.423 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 28.5 t-20 -53.03 114.88 1.6 Allowed 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 113.604 -1.298 . . . . 1.29 112.088 -177.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.668 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 7.5 m120 -73.71 -28.13 61.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.058 -0.519 . . . . 2.99 111.983 -176.701 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -54.38 -46.29 73.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.105 0.478 . . . . 2.52 110.431 178.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -76.68 -37.06 56.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.665 -0.698 . . . . 2.87 110.656 175.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.603 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -55.88 -61.37 2.42 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.189 -0.459 . . . . 3.2 111.396 -179.468 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.668 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 12.6 pt-20 -57.73 -35.51 70.79 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.623 0.249 . . . . 3.72 111.458 178.712 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 46.0 t -61.22 -45.15 95.76 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.006 0.431 . . . . 4.18 110.639 -177.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 11.9 mpt_? -84.42 -11.29 56.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.158 -0.473 . . . . 5.82 110.79 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -89.35 -33.66 16.81 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.916 -0.584 . . . . 4.77 110.42 -178.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -61.1 -30.66 74.25 Favored Glycine 0 N--CA 1.447 -0.572 0 CA-C-N 115.846 -0.615 . . . . 5.1 112.943 -177.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -79.18 -14.06 59.32 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.975 0.417 . . . . 5.72 110.618 178.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.58 ' HA ' ' HG2' ' A' ' 171' ' ' GLU . 37.2 mt-10 -90.43 4.93 49.56 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.043 -0.526 . . . . 5.88 110.352 177.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.519 ' HG3' HD22 ' A' ' 170' ' ' LEU . 19.3 tpp180 -62.68 -46.83 86.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.807 -0.633 . . . . 7.34 110.119 178.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.519 HD22 ' HG3' ' A' ' 169' ' ' ARG . 3.0 mm? -130.25 -24.97 2.51 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.842 -0.617 . . . . 6.97 110.238 177.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 171' ' ' GLU . . . . . 0.58 ' HG2' ' HA ' ' A' ' 168' ' ' GLU . 50.2 mt-10 63.57 -174.13 0.16 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.412 -0.813 . . . . 6.97 111.429 177.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 74.8 m80 -106.03 165.1 11.45 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.124 -0.695 . . . . 9.35 109.124 175.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -70.98 -41.35 71.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.132 0.492 . . . . 11.4 109.676 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 26.9 p-80 -83.97 87.79 7.13 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.606 0.717 . . . . 11.52 109.549 172.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 175' ' ' HIS . . . . . 0.476 ' O ' ' HB2' ' A' ' 176' ' ' HIS . 33.6 t-80 -94.29 -34.07 12.98 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.851 -0.613 . . . . 14.48 110.572 -177.366 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 176' ' ' HIS . . . . . 0.476 ' HB2' ' O ' ' A' ' 175' ' ' HIS . 29.3 m80 73.4 135.43 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 O-C-N 124.006 0.816 . . . . 15.37 111.399 -177.354 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -155.67 155.0 32.43 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.283 -0.871 . . . . 16.02 109.303 -178.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.422 HD13 ' HA ' ' A' ' 178' ' ' LEU . 3.9 mm? -72.52 93.56 1.59 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.019 0.438 . . . . 17.99 111.119 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.69 -27.7 66.2 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.917 -0.771 . . . . 19.19 108.917 173.191 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 59.2 m80 -126.74 90.98 3.26 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.996 -1.002 . . . . 22.26 109.522 173.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 11.1 p80 -89.13 137.81 31.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.798 -0.637 . . . . 22.51 111.138 -177.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 58.19 84.06 0.11 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.603 -0.726 . . . . 24.89 111.38 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -74.93 -34.32 62.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.593 -0.73 . . . . 25.58 110.581 178.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 17.4 p80 -131.96 134.25 45.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.241 0.543 . . . . 27.37 110.565 -179.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.406 -0.806 . . . . 29.06 110.161 -177.374 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.187 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -87.58 -66.92 1.32 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.778 -0.725 . . . . 2.97 111.764 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1003 ' ' CYS . . . . . . . . . . . . . 4.6 m 62.83 -148.85 0.35 Allowed 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 122.599 0.359 . . . . 1.94 110.913 177.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.749 ' HA ' ' CD1' ' B' 1008 ' ' LEU . 0.3 OUTLIER 39.69 -88.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.34 0.188 0 O-C-N 124.682 1.239 . . . . 1.63 113.682 176.349 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . -34.32 -35.04 0.04 OUTLIER Glycine 0 CA--C 1.536 1.389 0 O-C-N 123.395 0.434 . . . . 1.2 113.981 166.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -107.21 -44.73 4.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 117.329 0.564 . . . . 2.88 112.446 175.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1007 ' ' ALA . . . . . 0.476 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -58.57 -64.24 1.0 Allowed 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 113.046 0.758 . . . . 1.31 113.046 -165.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.749 ' CD1' ' HA ' ' B' 1004 ' ' VAL . 4.3 mp -71.0 -36.09 72.33 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-N 116.514 -0.312 . . . . 1.33 110.352 -172.355 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B 1009 ' ' ALA . . . . . 1.029 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -42.28 -45.21 4.12 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.38 -0.827 . . . . 0.88 110.245 168.515 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.794 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -77.16 -40.41 45.54 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.463 -1.244 . . . . 1.03 111.681 -178.58 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.496 ' CE1' ' H14' ' B' 1100 ' ' 33B . 39.2 m-85 -74.6 -30.27 61.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.784 0.326 . . . . 1.67 111.312 -177.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B 1012 ' ' GLY . . . . . 0.902 ' HA2' ' HZ ' ' A' ' 57' ' ' PHE . . . -71.63 -11.45 72.81 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 116.07 -0.514 . . . . 0.78 112.79 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.88 -17.11 60.63 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.171 0.51 . . . . 1.9 110.311 174.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 9.4 m -86.55 73.24 10.12 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.291 0.567 . . . . 1.44 110.304 -178.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.758 HG21 ' HA3' ' A' ' 98' ' ' GLY . 6.4 pt -132.58 39.8 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.321 -0.854 . . . . 2.91 109.337 176.023 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -106.36 -12.56 15.63 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.933 -1.031 . . . . 4.29 110.415 -175.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -107.35 91.25 3.58 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.68 -0.691 . . . . 8.17 110.323 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.502 0 CA-C-N 116.557 -0.292 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.794 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.5 ttp . . . . . 0 N--CA 1.48 1.042 0 CA-C-O 120.556 0.217 . . . . 6.21 110.775 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.8 p -135.57 -49.27 0.71 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.588 0.232 . . . . 1.87 111.41 -176.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -70.04 -1.76 10.79 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.966 0.358 . . . . 2.42 111.966 -174.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -60.1 -24.35 64.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.133 -0.485 . . . . 1.25 111.273 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.544 ' HB2' HD13 ' A' ' 134' ' ' LEU . 6.2 p30 -57.45 -30.08 64.73 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.898 -0.592 . . . . 1.78 111.601 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.508 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 18.5 tpp85 -55.51 -49.92 71.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.895 -0.593 . . . . 1.4 110.959 178.506 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.57 ' OE1' ' HA2' ' A' ' 40' ' ' GLY . 42.8 mt-10 -60.71 -43.13 98.21 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.679 -0.691 . . . . 0.68 111.596 -176.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.567 HD21 ' HB3' ' A' ' 43' ' ' SER . 4.8 mt -63.3 -34.84 78.57 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.237 -0.892 . . . . 1.16 109.534 -175.442 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.511 HG13 ' HE2' ' A' ' 130' ' ' MET . 53.4 t -68.63 -63.83 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 115.51 -0.768 . . . . 0.27 109.586 173.317 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 6' ' ' ARG . 97.9 t -49.55 -55.06 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.371 -0.831 . . . . 0.33 113.033 -176.04 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -57.66 -33.25 68.12 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.201 0.313 . . . . 0.59 111.067 -173.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.667 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 20.4 t80 -83.64 -39.32 20.41 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 120.573 -0.451 . . . . 1.61 111.464 -177.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.992 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.0 mp -58.04 -40.34 80.68 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 119.666 -0.813 . . . . 0.34 109.286 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.443 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 47.8 t -60.08 -41.72 93.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.428 -0.806 . . . . 1.05 110.548 175.476 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -66.08 -30.47 70.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.908 -0.587 . . . . 1.22 110.935 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.825 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 14.8 mmmt -73.05 -48.67 34.0 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 121.453 0.644 . . . . 1.41 109.852 -178.378 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.639 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . 10.8 mt -56.54 -33.27 65.92 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.516 -0.765 . . . . 1.35 111.002 172.339 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.8 t -68.23 -24.81 64.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.876 -0.602 . . . . 0.94 111.893 -178.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.825 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 23.2 pt20 -77.18 -16.65 59.02 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-O 121.395 0.617 . . . . 1.37 110.304 -177.335 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.696 ' HD2' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -105.04 -24.62 12.78 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.943 -1.026 . . . . 2.2 109.365 -179.364 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.04 23.14 8.74 Favored Glycine 0 N--CA 1.439 -1.115 0 CA-C-N 114.189 -1.369 . . . . 0.53 112.936 176.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -99.22 164.58 12.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.737 0.304 . . . . 0.76 110.295 172.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.1 t -103.22 148.28 25.99 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.145 0.497 . . . . 0.52 110.671 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.651 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 58.3 t-105 -75.53 -54.26 7.29 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.433 -0.803 . . . . 3.36 109.557 174.509 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.1 m -62.4 -32.8 73.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.703 -0.68 . . . . 1.37 111.948 -173.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -60.29 -28.83 68.4 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 111.921 0.341 . . . . 1.11 111.921 -178.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -117.27 -2.44 11.61 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.222 0.453 . . . . 1.28 112.222 -175.036 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.628 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 51.5 m -102.04 155.48 18.15 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-O 122.155 0.978 . . . . 1.81 113.181 -175.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -130.79 -0.22 4.29 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 113.321 -1.763 . . . . 2.31 109.163 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.888 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.9 m -59.99 -75.68 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.434 -1.257 . . . . 0.92 113.239 -167.32 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.888 ' H ' HG23 ' A' ' 30' ' ' VAL . 33.1 mm-40 -92.03 -2.9 56.44 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.679 -0.859 . . . . 2.74 108.679 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -64.08 -41.97 97.13 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.717 -1.129 . . . . 1.45 110.711 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -101.26 -53.9 2.91 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.517 -0.765 . . . . 1.87 110.731 -175.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.551 ' O ' ' HA ' ' A' ' 31' ' ' GLU . 17.6 ptt180 -113.48 133.55 55.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.051 0.453 . . . . 3.39 110.538 176.142 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.6 p -96.45 107.31 19.69 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.735 -0.666 . . . . 2.25 110.345 179.18 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -95.31 -66.35 0.92 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.38 -0.827 . . . . 3.34 111.415 -173.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.508 ' HB2' ' HB3' ' A' ' 6' ' ' ARG . . . -92.92 154.45 41.9 Favored Pre-proline 0 C--N 1.317 -0.829 0 CA-C-N 115.672 -0.695 . . . . 1.92 111.334 -177.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.523 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 27.2 Cg_exo -63.39 -176.87 0.33 Allowed 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.323 2.682 . . . . 1.87 112.426 177.522 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -81.08 9.71 6.3 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.307 0.575 . . . . 4.64 110.509 179.033 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.57 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 130.04 72.87 0.13 Allowed Glycine 0 N--CA 1.441 -1.014 0 N-CA-C 110.991 -0.843 . . . . 2.15 110.991 -176.186 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.874 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.8 t -76.6 -77.35 0.14 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 120.369 -0.533 . . . . 1.12 110.371 -175.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.874 ' H ' HG23 ' A' ' 41' ' ' THR . 11.1 pt-20 -94.08 -30.44 14.66 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 123.011 1.386 . . . . 2.02 107.783 165.701 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.6 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.0 OUTLIER -60.86 -25.66 66.83 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 112.135 -2.302 . . . . 1.25 113.43 -171.245 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -53.08 -51.36 62.07 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 120.758 0.313 . . . . 1.91 110.635 179.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.548 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -74.62 -35.6 62.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.07 0.462 . . . . 0.52 110.212 178.301 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.704 ' HA ' ' CG1' ' A' ' 152' ' ' VAL . 95.1 t -58.91 -60.42 2.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.295 -0.866 . . . . 1.41 111.372 179.074 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.579 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 11.6 ptpt -59.36 -35.57 74.15 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.258 -0.645 . . . . 0.67 109.258 -178.706 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.563 ' OE1' ' HD2' ' A' ' 51' ' ' ARG . 4.9 mm-40 -66.63 -30.33 70.58 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.404 -0.817 . . . . 0.99 110.654 -179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.804 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -83.5 -38.46 21.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.243 0.544 . . . . 0.42 110.463 176.173 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.513 HD12 ' CE2' ' A' ' 151' ' ' PHE . 0.8 OUTLIER -65.88 -27.31 68.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.382 -0.827 . . . . 1.33 111.576 -176.368 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 6.4 ptp180 -81.41 -24.11 37.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.385 0.612 . . . . 2.17 109.494 -178.169 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -75.49 -44.97 41.15 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.927 -1.033 . . . . 1.1 109.271 174.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.78 -43.58 95.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.512 -0.767 . . . . 0.53 109.885 173.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.645 ' O ' ' HG2' ' A' ' 58' ' ' GLU . . . -65.73 -32.82 84.21 Favored Glycine 0 C--O 1.221 -0.663 0 CA-C-N 115.356 -0.838 . . . . 0.7 112.058 177.301 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -57.96 -48.02 81.22 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.842 -0.429 . . . . 1.04 109.842 178.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -66.42 -27.33 67.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.339 -0.846 . . . . 2.29 111.17 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.619 ' CE2' ' HA ' ' A' ' 102' ' ' ALA . 5.4 t80 -80.76 -27.86 36.64 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.32 -0.4 . . . . 2.29 111.47 -178.222 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.645 ' HG2' ' O ' ' A' ' 54' ' ' GLY . 36.9 mm-40 -49.82 -69.04 0.13 Allowed 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 112.216 0.451 . . . . 1.3 112.216 -178.471 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.809 HD13 ' H ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -53.98 -35.45 61.84 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.248 -0.887 . . . . 1.54 111.343 -179.443 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.711 ' N ' HD22 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -51.63 -62.07 1.85 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.607 -0.724 . . . . 2.58 112.33 175.681 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.454 ' HD1' ' HB3' ' A' ' 65' ' ' PHE . 31.1 p90 -90.98 -11.41 39.01 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 112.022 0.378 . . . . 5.32 112.022 -175.444 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.757 ' HG3' ' HE1' ' A' ' 65' ' ' PHE . 43.0 ttm180 -62.38 -29.72 70.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.674 0.273 . . . . 4.48 111.277 -175.806 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -64.84 -35.14 80.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.345 -0.389 . . . . 4.72 110.622 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.408 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -91.52 -50.4 5.8 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.396 0.517 . . . . 1.17 112.396 -176.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.971 ' HA ' ' HB2' ' A' ' 68' ' ' LEU . 1.3 p90 -57.59 -27.32 62.61 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 112.581 0.586 . . . . 2.81 112.581 -166.59 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.6 p -64.29 -33.35 75.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.01 0.433 . . . . 2.19 110.539 177.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -90.28 -32.45 16.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.496 0.665 . . . . 2.72 109.738 174.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.971 ' HB2' ' HA ' ' A' ' 65' ' ' PHE . 3.3 mp -60.1 -19.73 54.79 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-N 115.205 -0.907 . . . . 1.56 112.506 -177.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.663 HG22 HG13 ' A' ' 74' ' ' ILE . 1.3 p -58.15 -28.43 64.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 118.29 0.496 . . . . 0.7 111.114 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 21.8 t -71.53 -37.3 71.19 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 109.365 -0.606 . . . . 1.34 109.365 173.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.45 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 46.1 mt-30 -68.44 -40.18 81.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.432 -0.804 . . . . 1.42 110.088 178.614 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.443 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.0 mm? -68.72 -32.56 72.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.609 -0.269 . . . . 1.37 110.64 172.542 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.5 m80 60.84 49.23 6.19 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.476 -0.935 . . . . 2.72 108.476 -170.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.663 HG13 HG22 ' A' ' 69' ' ' THR . 33.1 mm -51.3 113.05 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 113.805 -1.543 . . . . 0.91 112.325 -176.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.775 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -154.55 -172.93 0.34 Allowed Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 107.522 -1.288 . . . . 0.51 107.522 -171.804 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.775 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.4 Cg_exo -29.91 166.28 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.332 0 C-N-CA 125.185 3.923 . . . . 0.47 115.466 166.224 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.514 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.26 -31.2 0.01 OUTLIER Glycine 0 N--CA 1.472 1.048 0 N-CA-C 117.307 1.683 . . . . 0.4 117.307 -173.233 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 76' ' ' PRO . 18.2 p -66.14 2.03 1.3 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 117.653 0.726 . . . . 0.56 112.243 -179.065 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.25 -12.46 61.69 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.182 0.515 . . . . 0.34 110.012 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.509 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 5.5 p90 -73.58 -21.76 60.25 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 109.212 -0.662 . . . . 4.13 109.212 175.088 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.458 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 37.4 mt-30 -80.82 -25.58 37.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.867 0.841 . . . . 1.03 109.553 175.186 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.9 m -71.34 -51.67 22.96 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 114.482 -1.235 . . . . 0.48 109.524 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.598 ' HE1' ' HB2' ' A' ' 106' ' ' PHE . 78.5 t80 -68.87 -18.65 64.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.057 -0.974 . . . . 1.18 110.467 176.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.619 ' HA ' HG12 ' A' ' 87' ' ' VAL . 37.4 tt0 -59.51 -49.25 78.5 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.391 -0.822 . . . . 0.8 110.339 176.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.47 ' OE1' HG21 ' B' 1004 ' ' VAL . 66.1 mt-30 -48.45 -32.6 7.99 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.805 -1.089 . . . . 1.62 110.737 176.089 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.784 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -83.83 -53.07 11.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.803 -1.09 . . . . 1.3 110.815 -177.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.619 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.6 p -61.44 -23.92 32.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.492 0.663 . . . . 0.85 109.602 -179.057 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.695 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.6 m-80 -68.47 -52.77 28.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.581 -1.191 . . . . 0.91 111.102 174.11 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.937 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.8 OUTLIER -63.22 -36.54 83.98 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 121.881 0.848 . . . . 2.87 108.762 -178.303 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.637 ' HG ' ' CD ' ' A' ' 89' ' ' GLU . 19.1 mt -68.89 -22.35 64.19 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 113.731 -1.577 . . . . 1.28 112.527 -167.489 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.73 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 5.6 p90 -106.79 -32.11 8.1 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 120.494 -0.483 . . . . 2.3 111.842 -174.309 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.695 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.0 OUTLIER -81.54 -24.41 36.62 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.243 0.544 . . . . 5.06 110.854 -172.689 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.474 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 0.4 OUTLIER -98.53 18.52 16.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.518 -0.764 . . . . 3.12 112.713 -170.249 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 116.19 68.88 0.42 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 117.829 -2.129 . . . . 2.31 114.756 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.73 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 63.5 t -70.49 105.39 1.42 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 CA-C-N 118.276 1.038 . . . . 1.06 111.277 -176.293 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.467 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 3.5 p30 -110.12 -170.66 1.69 Allowed 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 113.675 -1.602 . . . . 2.12 108.229 172.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.828 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 23.2 m-90 -62.86 -35.06 78.73 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.84 0.352 . . . . 3.34 110.633 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.452 ' HA2' HG13 ' A' ' 101' ' ' VAL . . . -73.75 -38.47 50.05 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.996 -0.547 . . . . 0.69 113.697 -176.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.467 ' HG2' ' ND2' ' A' ' 96' ' ' ASN . 16.1 mmt180 -54.19 -31.74 53.75 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.225 0.536 . . . . 4.24 111.563 -178.515 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.429 HG12 ' HG ' ' A' ' 138' ' ' LEU . 78.9 mt -83.19 -34.16 10.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.954 -0.566 . . . . 0.44 111.653 -174.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.452 HG13 ' HA2' ' A' ' 98' ' ' GLY . 1.1 m -66.93 -25.97 35.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 109.344 -0.613 . . . . 1.35 109.344 171.491 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.619 ' HA ' ' CE2' ' A' ' 57' ' ' PHE . . . -68.5 -51.87 38.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.194 0.521 . . . . 0.44 109.71 172.474 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -49.37 -54.56 16.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.5 -1.227 . . . . 1.49 111.936 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.507 ' HA ' ' CE ' ' A' ' 130' ' ' MET . 0.3 OUTLIER -73.49 -19.08 61.03 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 120.645 -0.422 . . . . 3.29 111.441 -172.844 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.667 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 67.9 m -77.31 -49.27 15.35 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.509 0.195 . . . . 1.19 110.653 177.705 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.651 ' CZ ' HD12 ' B' 1008 ' ' LEU . 19.2 m-85 -60.51 -39.55 88.18 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 110.092 -0.336 . . . . 2.89 110.092 177.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.893 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.99 -38.98 94.63 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.875 -0.678 . . . . 0.3 111.959 177.462 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.992 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.6 -40.8 99.04 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.612 -0.804 . . . . 0.23 111.362 175.541 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.13 -32.2 66.71 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.771 0.32 . . . . 0.31 110.76 177.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.544 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -58.31 -39.89 80.58 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 108.377 -0.972 . . . . 1.12 108.377 179.48 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.75 ' SG ' HG22 ' A' ' 123' ' ' VAL . 40.1 t -51.25 -64.11 0.92 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 113.713 -1.585 . . . . 0.26 110.247 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.835 ' HA ' HG13 ' A' ' 115' ' ' VAL . 44.6 t -61.57 -37.17 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-N 116.508 -0.314 . . . . 0.35 111.826 -175.365 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.476 ' HG3' ' CG2' ' A' ' 69' ' ' THR . 4.0 mm-40 -60.21 -21.81 62.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.105 0.479 . . . . 2.51 110.67 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.435 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 70.3 m -83.74 -42.77 16.19 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 108.061 -1.088 . . . . 0.28 108.061 179.071 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.835 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.6 m -68.9 -28.79 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-N 114.796 -1.093 . . . . 1.23 109.515 -177.44 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -51.67 -51.03 59.1 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 113.26 -1.791 . . . . 0.6 110.919 174.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 15.5 mmtp -84.7 13.92 5.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.523 -0.762 . . . . 1.62 110.285 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 65.31 46.12 2.71 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.95 0.881 . . . . 1.88 109.976 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.435 ' CE ' ' HA ' ' A' ' 114' ' ' SER . 26.8 mtm -126.7 38.24 4.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.559 -1.201 . . . . 0.31 107.889 -178.438 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.753 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 10.2 mp0 -54.68 -8.05 0.21 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 114.775 -1.102 . . . . 1.15 113.048 -179.367 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.582 HG23 HD22 ' A' ' 122' ' ' LEU . 16.5 m -64.0 -27.56 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 O-C-N 121.831 -0.543 . . . . 0.46 111.477 174.051 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.582 HD22 HG23 ' A' ' 121' ' ' VAL . 3.2 mm? -70.04 -25.48 63.58 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 110.235 -0.284 . . . . 0.26 110.235 178.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.75 HG22 ' SG ' ' A' ' 111' ' ' CYS . 55.2 t -47.7 -51.38 7.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.587 -0.733 . . . . 0.25 111.819 -178.549 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.628 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 14.6 t -75.62 -31.48 59.89 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.881 0.372 . . . . 1.35 110.598 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.499 ' NH1' ' HA3' ' A' ' 77' ' ' GLY . 58.6 mtp180 -66.42 -55.25 16.66 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 116.205 -0.452 . . . . 2.67 110.418 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.544 HD13 ' HB3' ' A' ' 110' ' ' LEU . 87.7 mt -53.64 -42.82 52.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.591 -0.731 . . . . 0.23 111.799 -175.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.651 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -60.27 -35.0 74.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.923 -0.311 . . . . 0.29 110.89 178.371 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -64.15 -59.76 4.04 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.636 0.731 . . . . 0.28 109.832 176.305 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.495 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 94.3 m95 -54.05 -46.15 71.86 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.251 -1.34 . . . . 3.91 110.437 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.893 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 1.4 mmm -59.15 -59.41 5.51 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.784 -0.644 . . . . 1.08 112.067 -177.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -59.81 -36.05 75.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 120.685 -0.406 . . . . 0.25 110.392 -177.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.429 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 23.3 m -64.49 -49.22 72.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.601 -0.272 . . . . 0.4 111.571 176.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.486 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 14.1 m-85 -58.0 -36.37 72.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.766 0.317 . . . . 3.13 110.351 178.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.733 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.5 tt -64.85 -51.06 64.09 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.986 -0.746 . . . . 0.95 108.986 171.81 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' ASN . . . . . 0.429 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 4.5 m-80 -48.7 -49.59 37.2 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.07 0.548 . . . . 0.46 112.034 178.392 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -80.15 -50.59 10.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.258 -0.428 . . . . 0.59 111.897 -174.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' HIS . . . . . 0.486 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 22.2 m-70 -90.69 -51.69 5.25 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.067 0.765 . . . . 1.45 113.067 -170.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.733 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -82.71 -45.89 13.87 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.291 0.848 . . . . 1.2 113.291 -167.078 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.69 ' HA ' HD12 ' A' ' 142' ' ' ILE . 22.8 tt0 -42.08 -53.64 8.24 Favored Pre-proline 0 CA--C 1.542 0.652 0 O-C-N 124.123 0.89 . . . . 0.75 113.167 -172.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.49 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 19.3 Cg_endo -61.09 -47.6 12.12 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.889 1.726 . . . . 0.56 111.998 178.749 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -55.37 -46.92 76.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.72 -0.673 . . . . 1.2 110.065 177.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.69 HD12 ' HA ' ' A' ' 139' ' ' GLU . 48.4 mt -49.08 -52.06 11.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.793 -0.64 . . . . 0.32 111.798 175.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.8 mm-40 -59.9 -30.67 69.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.984 -0.553 . . . . 0.57 111.434 -179.061 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.7 mm-40 -65.63 -20.81 66.46 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.705 0.764 . . . . 0.78 110.594 176.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -111.29 10.92 21.67 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.002 -0.999 . . . . 0.93 109.917 -175.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 114.39 -46.84 1.11 Allowed Glycine 0 N--CA 1.44 -1.044 0 CA-C-N 114.861 -1.063 . . . . 0.56 112.813 173.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' GLY . . . . . 0.581 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 131.56 178.46 15.49 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.717 -0.754 . . . . 0.49 111.9 -177.536 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.525 ' NE1' HD13 ' A' ' 142' ' ' ILE . 7.0 m-90 -68.54 -41.9 79.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.62 0.248 . . . . 3.57 110.778 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.43 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 23.3 t70 -59.84 -37.75 80.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.32 0.581 . . . . 1.96 109.862 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.644 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 62.2 m -60.93 -37.53 82.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.306 -0.861 . . . . 0.67 111.183 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.828 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 74.6 t80 -59.33 -40.53 86.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.059 0.457 . . . . 3.0 109.954 177.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.704 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -74.6 -24.89 18.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.475 0.655 . . . . 1.15 110.094 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 31.8 mm-40 -66.38 -22.9 66.25 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.396 0.617 . . . . 1.67 110.082 172.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.644 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.7 mt -93.82 -58.53 2.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.648 -0.705 . . . . 1.3 110.552 177.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -122.07 30.16 6.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.047 -0.524 . . . . 4.24 111.594 -173.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.804 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -62.95 155.72 41.87 Favored Glycine 0 CA--C 1.502 -0.764 0 CA-C-O 121.654 0.585 . . . . 1.1 113.682 -177.437 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.431 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 21.6 t-20 -54.99 132.02 46.06 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 113.842 -1.179 . . . . 1.29 110.283 175.466 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.491 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 6.6 p-10 -80.02 17.97 0.9 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.454 0.538 . . . . 2.99 112.454 -174.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.407 ' HB2' ' OD1' ' A' ' 157' ' ' ASN . . . -49.37 -41.28 38.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.678 0.275 . . . . 2.52 111.549 177.839 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -74.4 -36.94 63.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.55 -0.295 . . . . 2.87 110.511 179.236 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.441 ' HB3' ' HB2' ' A' ' 158' ' ' ASN . . . -54.78 -59.31 4.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.058 -0.519 . . . . 3.2 111.113 177.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.548 ' O ' ' HB3' ' A' ' 165' ' ' LYS . 4.5 pt-20 -66.35 -25.62 66.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.153 -0.476 . . . . 3.72 111.834 179.071 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 7.6 t -70.42 -33.35 71.24 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.372 -0.603 . . . . 4.18 109.372 176.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 40.3 mmt180 -72.15 -39.41 68.77 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.4 0.619 . . . . 5.82 109.478 172.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.548 ' HB3' ' O ' ' A' ' 162' ' ' GLU . 24.4 ttpt -48.7 -49.68 36.8 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.236 -1.347 . . . . 4.77 111.503 178.159 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -63.51 -40.01 98.28 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-N 115.818 -0.628 . . . . 5.1 113.39 -174.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -85.59 -18.84 32.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.984 0.421 . . . . 5.72 111.288 -178.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.532 ' HG2' ' HB2' ' A' ' 172' ' ' HIS . 35.0 tt0 -73.79 -12.96 60.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.855 -0.611 . . . . 5.88 110.085 176.445 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -56.06 -36.33 67.94 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.344 -0.844 . . . . 7.34 111.291 -175.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -76.81 -50.87 12.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.353 -0.385 . . . . 6.97 111.995 -176.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -78.86 -30.85 45.31 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 111.963 0.356 . . . . 6.97 111.963 -173.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 172' ' ' HIS . . . . . 0.532 ' HB2' ' HG2' ' A' ' 168' ' ' GLU . 75.1 m80 -121.78 110.09 15.49 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.97 0.414 . . . . 9.35 109.933 177.42 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 51.4 m-70 -90.14 116.56 28.24 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.861 -0.609 . . . . 11.4 110.724 -176.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -68.56 -40.94 80.43 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.067 -0.716 . . . . 11.52 109.067 174.254 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -95.6 110.89 22.92 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.973 -0.751 . . . . 14.48 108.973 169.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -93.65 9.13 38.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.956 -0.565 . . . . 15.37 110.909 -174.017 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -142.38 135.27 28.42 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.668 -0.697 . . . . 16.02 110.382 173.238 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 43.6 tp -141.4 -70.14 0.37 Allowed 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.208 -0.664 . . . . 17.99 109.208 177.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -137.61 158.79 43.62 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.615 -0.72 . . . . 19.19 109.732 178.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 50.1 m80 -100.51 -70.11 0.75 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.393 -0.367 . . . . 22.26 110.181 -178.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 10.5 m170 66.52 159.94 0.14 Allowed 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.736 -0.665 . . . . 22.51 111.774 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 58.53 -96.51 0.06 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.377 -0.829 . . . . 24.89 111.266 -176.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 35.9 m80 -151.24 142.71 23.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.804 0.335 . . . . 25.58 110.641 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -96.55 126.69 41.91 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.185 -0.672 . . . . 27.37 109.185 175.036 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 55.4 t60 . . . . . 0 C--O 1.246 0.881 0 CA-C-O 118.312 -0.852 . . . . 29.06 109.911 -177.817 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.206 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . 78.42 -84.43 1.18 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.001 -0.619 . . . . 2.97 112.526 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.446 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . 30.4 m -122.51 -153.2 0.54 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.98 -0.378 . . . . 1.94 109.98 -178.725 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.996 HG23 ' H ' ' B' 1005 ' ' GLY . 13.5 m 50.74 -88.36 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 124.849 1.259 . . . . 1.63 112.985 172.126 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B 1005 ' ' GLY . . . . . 0.996 ' H ' HG23 ' B' 1004 ' ' VAL . . . -34.94 -36.73 0.08 OUTLIER Glycine 0 CA--C 1.53 1.008 0 CA-C-N 119.078 0.854 . . . . 1.2 112.954 161.352 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B 1006 ' ' ARG . . . . . 0.539 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 6.9 mpt_? -89.23 -51.47 5.56 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.846 0.355 . . . . 2.88 111.281 174.405 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B 1007 ' ' ALA . . . . . 0.577 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -69.07 -62.83 1.22 Allowed 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 113.244 0.831 . . . . 1.31 113.244 -167.054 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.651 HD12 ' CZ ' ' A' ' 106' ' ' PHE . 3.2 mm? -58.63 -53.23 60.72 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.149 -0.315 . . . . 1.33 110.149 -176.307 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B 1009 ' ' ALA . . . . . 0.937 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -38.0 -50.43 1.33 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.102 -0.954 . . . . 0.88 111.991 171.142 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.804 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -70.2 -47.88 59.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.084 -0.962 . . . . 1.03 111.706 -177.25 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.557 ' HE2' ' H8 ' ' B' 1100 ' ' 33B . 31.5 m-85 -66.52 -27.42 67.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.007 0.432 . . . . 1.67 111.247 -179.108 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.67 -11.14 80.54 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.939 -0.573 . . . . 0.78 112.905 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 36.0 t70 -76.51 -5.32 47.04 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.17 0.509 . . . . 1.9 110.647 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 10.0 m -96.85 8.2 44.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.09 -0.505 . . . . 1.44 111.053 -177.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.435 HD11 ' CE1' ' A' ' 57' ' ' PHE . 26.6 mt -93.62 67.52 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.495 0.664 . . . . 2.91 109.835 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -129.46 -42.95 1.29 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.331 -0.85 . . . . 4.29 109.86 178.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -119.19 92.06 3.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.803 -0.635 . . . . 8.17 110.213 176.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.584 0 CA-C-N 116.583 -0.281 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.804 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.2 mtt . . . . . 0 N--CA 1.483 1.189 0 CA-C-O 120.922 0.391 . . . . 6.21 110.807 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.441 ' HB2' ' OD1' ' A' ' 135' ' ' ASN . 3.0 p -79.2 0.95 26.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.894 0.378 . . . . 1.87 111.713 -176.355 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 -102.0 -2.78 28.9 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 122.058 -0.401 . . . . 2.42 110.812 175.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.1 t -86.67 -22.58 26.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.963 0.411 . . . . 1.25 110.731 -177.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.783 ' HA ' HD22 ' A' ' 8' ' ' LEU . 8.2 p30 -67.75 -22.66 65.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.106 0.479 . . . . 1.78 110.05 173.236 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.965 HH12 ' HA ' ' A' ' 128' ' ' ALA . 21.1 tpp180 -55.56 -49.6 72.26 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 115.263 -0.88 . . . . 1.4 109.778 175.779 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -56.3 -52.28 65.09 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.475 -1.239 . . . . 0.68 111.176 -177.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.783 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.8 OUTLIER -44.54 -43.73 8.21 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.269 -0.878 . . . . 1.16 111.167 175.733 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.461 HG13 ' HE2' ' A' ' 130' ' ' MET . 76.1 t -72.17 -61.41 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.337 0.589 . . . . 0.27 110.482 176.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 6' ' ' ARG . 68.2 t -52.91 -52.71 26.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.062 -0.972 . . . . 0.33 113.036 -174.183 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -55.7 -34.52 65.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.066 0.46 . . . . 0.59 110.549 -175.343 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.696 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 24.2 t80 -80.38 -43.01 21.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 116.102 -0.499 . . . . 1.61 111.132 -178.052 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.834 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 3.9 mp -59.02 -41.63 88.24 Favored 'General case' 0 CA--C 1.522 -0.113 0 C-N-CA 120.066 -0.654 . . . . 0.34 109.526 176.408 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -55.58 -43.21 75.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.641 -0.709 . . . . 1.05 110.604 176.038 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -71.45 -33.61 69.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.416 -0.811 . . . . 1.22 110.831 -177.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.711 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 9.9 mmpt? -76.54 -27.87 56.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.509 -0.314 . . . . 1.41 111.593 -177.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.597 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -73.55 -29.51 62.49 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 120.103 -0.639 . . . . 1.35 109.871 174.512 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.3 t -65.57 -28.83 69.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.79 -0.641 . . . . 0.94 111.526 -176.346 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 28.5 pt20 -79.14 -5.88 55.21 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.433 0.635 . . . . 1.37 110.86 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.488 ' HD2' ' HG3' ' A' ' 19' ' ' GLN . 18.6 mmmt -108.77 -25.17 10.95 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 122.148 0.975 . . . . 2.2 108.946 -179.419 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.81 25.78 7.88 Favored Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 113.605 -1.634 . . . . 0.53 111.227 179.136 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -120.33 166.74 13.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.315 -0.442 . . . . 0.76 110.669 177.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.503 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 4.6 t -112.35 149.8 31.96 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.071 -0.513 . . . . 0.52 110.327 178.25 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.423 ' CE2' HG13 ' A' ' 10' ' ' VAL . 2.8 t90 -67.63 -50.65 56.99 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.031 0.443 . . . . 3.36 109.963 172.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.511 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 3.8 p -64.08 -31.65 72.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.559 -0.746 . . . . 1.37 111.738 -171.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.503 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 95.0 mt-30 -56.4 -27.42 56.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.924 0.392 . . . . 1.11 111.371 178.046 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -120.61 11.33 11.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.26 -0.427 . . . . 1.28 111.382 -175.388 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.604 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 59.0 p -98.02 -178.05 3.95 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.784 0.661 . . . . 1.81 112.784 -170.023 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.53 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 11.1 t70 -170.66 -26.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 114.649 -1.16 . . . . 2.31 109.441 -177.408 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.896 HG23 ' H ' ' A' ' 31' ' ' GLU . 6.6 m -47.43 -72.21 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-N 114.586 -1.188 . . . . 0.92 112.866 -174.077 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.896 ' H ' HG23 ' A' ' 30' ' ' VAL . 7.9 pt-20 -102.48 1.17 34.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.483 0.659 . . . . 2.74 109.386 175.429 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.53 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 15.5 tt0 -58.21 -42.21 85.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.017 -0.992 . . . . 1.45 111.435 -179.382 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -90.27 4.41 50.75 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.349 -0.842 . . . . 1.87 113.024 -171.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -149.46 143.85 25.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.222 0.534 . . . . 3.39 111.896 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.0 p -111.17 100.15 8.86 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.729 -0.668 . . . . 2.25 110.146 176.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -135.46 -71.18 0.47 Allowed 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.659 -0.701 . . . . 3.34 111.839 -167.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.639 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -66.08 160.8 61.22 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.848 -0.614 . . . . 1.92 112.545 -174.155 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.697 ' HB2' ' H ' ' A' ' 40' ' ' GLY . 31.5 Cg_endo -60.58 174.42 1.62 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 124.44 3.427 . . . . 1.87 113.016 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -84.07 -1.73 55.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.562 -0.903 . . . . 4.64 108.562 168.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.697 ' H ' ' HB2' ' A' ' 38' ' ' PRO . . . 146.89 81.47 0.04 OUTLIER Glycine 0 N--CA 1.437 -1.244 0 CA-C-N 114.018 -1.447 . . . . 2.15 111.022 -179.334 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.862 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.8 t -64.27 -73.91 0.11 Allowed 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 109.29 -0.633 . . . . 1.12 109.29 -176.745 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.862 ' H ' HG23 ' A' ' 41' ' ' THR . 13.7 pt-20 -93.28 -29.87 15.45 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 122.66 1.219 . . . . 2.02 108.418 164.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.716 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 6.7 p -60.42 -23.35 64.31 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 112.595 -2.093 . . . . 1.25 113.77 -170.241 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -55.91 -46.02 78.54 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.124 -0.63 . . . . 1.91 109.9 179.167 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.511 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -76.57 -34.94 58.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.071 0.462 . . . . 0.52 110.35 177.04 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.716 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 88.1 t -61.06 -61.08 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.514 -0.766 . . . . 1.41 111.302 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.1 ptpt -59.91 -34.74 73.6 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.088 -0.708 . . . . 0.67 109.088 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.636 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 28.8 mm-40 -64.79 -41.49 95.8 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.729 -0.669 . . . . 0.99 110.393 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.779 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -67.71 -36.38 80.51 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.336 0.589 . . . . 0.42 110.392 175.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.2 mp -72.41 -24.14 61.19 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.411 -0.813 . . . . 1.33 111.524 -178.255 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.636 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -81.31 -18.48 45.63 Favored 'General case' 0 CA--C 1.509 -0.613 0 C-N-CA 119.453 -0.899 . . . . 2.17 109.027 178.0 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.477 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 4.3 mm-40 -80.46 -54.38 5.74 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.597 -1.183 . . . . 1.1 109.983 175.302 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.83 -41.11 99.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.38 -0.827 . . . . 0.53 109.907 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.685 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -64.04 -43.61 97.08 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.299 -0.864 . . . . 0.7 111.413 175.465 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 51' ' ' ARG . 19.1 t70 -52.85 -50.11 64.42 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.432 0.293 . . . . 1.04 110.964 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.736 ' O ' ' HG2' ' A' ' 60' ' ' ARG . 41.4 mt-10 -65.32 -28.22 69.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.138 -0.483 . . . . 2.29 110.955 179.419 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.514 ' HE2' ' HB2' ' A' ' 102' ' ' ALA . 0.3 OUTLIER -81.09 -19.86 42.75 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.388 -0.369 . . . . 2.29 111.983 177.732 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.685 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 92.1 mt-10 -62.57 -57.07 12.44 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 122.516 -0.115 . . . . 1.3 111.15 -178.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.866 ' H ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -62.99 -31.96 73.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.727 -0.215 . . . . 1.54 111.255 179.191 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.736 ' HG2' ' O ' ' A' ' 56' ' ' GLU . 18.7 mmt180 -50.2 -52.03 39.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.231 -0.441 . . . . 2.58 110.8 173.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.476 ' HB2' ' CZ ' ' A' ' 65' ' ' PHE . 28.9 m-85 -92.47 -3.83 54.57 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.206 -0.452 . . . . 5.32 111.827 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.797 ' HB2' ' HA ' ' A' ' 59' ' ' LEU . 21.7 tpp180 -50.43 -50.81 51.04 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.577 0.584 . . . . 4.48 112.577 -171.058 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -71.41 -16.29 62.39 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.191 0.519 . . . . 4.72 111.084 -177.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.499 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -90.2 -38.98 13.09 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.498 0.555 . . . . 1.17 112.498 -172.436 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.476 ' CZ ' ' HB2' ' A' ' 61' ' ' TYR . 44.8 m-85 -45.56 -46.46 14.16 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.247 0.832 . . . . 2.81 113.247 -170.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.9 t -66.27 -27.14 67.71 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.086 0.47 . . . . 2.19 111.215 -174.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -88.56 -34.49 17.34 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.497 0.665 . . . . 2.72 109.502 176.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.709 ' O ' HD12 ' A' ' 72' ' ' LEU . 5.5 mp -66.45 -31.37 72.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.139 -0.937 . . . . 1.56 112.595 -176.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.71 HG22 HG13 ' A' ' 74' ' ' ILE . 11.7 p -61.17 -24.23 66.16 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.109 -0.636 . . . . 0.7 110.661 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.1 t -77.65 -41.02 39.75 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.824 -0.625 . . . . 1.34 109.391 172.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.609 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 44.1 mt-30 -61.03 -49.48 77.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.369 -0.832 . . . . 1.42 110.588 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.73 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.2 mp -75.53 -31.33 60.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.63 -0.713 . . . . 1.37 110.603 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 48.0 m80 65.92 59.69 0.7 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.64 0.733 . . . . 2.72 109.131 -172.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.71 HG13 HG22 ' A' ' 69' ' ' THR . 23.6 mm -59.29 112.79 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.4 -1.273 . . . . 0.91 111.382 -178.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.741 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -153.07 -171.97 0.3 Allowed Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 107.781 -1.192 . . . . 0.51 107.781 -170.029 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.741 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 21.7 Cg_exo -30.25 166.2 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 124.911 3.74 . . . . 0.47 114.935 165.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.498 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -29.59 -30.23 0.01 OUTLIER Glycine 0 N--CA 1.472 1.058 0 N-CA-C 117.282 1.673 . . . . 0.4 117.282 -172.085 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.457 ' N ' ' O ' ' A' ' 76' ' ' PRO . 32.2 p -67.87 6.12 0.75 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 118.019 0.909 . . . . 0.56 112.157 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.57 -12.92 61.87 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.962 0.411 . . . . 0.34 109.982 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.498 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 5.0 p90 -78.26 -16.34 57.89 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.15 0.5 . . . . 4.13 109.68 175.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.534 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 32.3 mt-30 -84.78 -24.51 28.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.775 0.798 . . . . 1.03 109.604 171.419 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.73 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 13.0 m -73.46 -52.1 14.84 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 114.566 -1.197 . . . . 0.48 109.361 172.221 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.564 ' HA ' HG23 ' A' ' 86' ' ' VAL . 86.9 t80 -67.14 -17.02 64.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.183 -0.917 . . . . 1.18 109.908 175.143 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.635 ' HA ' HG12 ' A' ' 87' ' ' VAL . 43.0 tt0 -58.54 -48.86 79.47 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.033 -0.531 . . . . 0.8 110.195 174.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -47.14 -35.45 7.24 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.176 -0.92 . . . . 1.62 110.917 174.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.76 HG13 ' HG ' ' B' 1008 ' ' LEU . 1.7 t -82.14 -49.91 16.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 114.534 -1.212 . . . . 1.3 110.503 -175.708 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.635 HG12 ' HA ' ' A' ' 84' ' ' GLU . 8.4 p -62.8 -21.35 27.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 O-C-N 121.494 -0.754 . . . . 0.85 109.991 179.093 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.489 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 3.0 m-80 -78.44 -37.34 43.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.373 -1.285 . . . . 0.91 112.475 177.505 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 1.104 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.3 pp20? -73.38 -29.27 62.52 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 108.904 -0.776 . . . . 2.87 108.904 175.711 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.759 ' HB3' ' NH1' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -72.72 -35.82 67.65 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-N 114.549 -1.205 . . . . 1.28 111.401 -168.087 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.489 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -103.87 12.91 33.85 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.136 0.493 . . . . 2.3 110.918 -173.168 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.903 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -51.91 -43.12 63.26 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.404 -0.816 . . . . 5.06 112.09 -178.318 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.591 ' H ' ' HD3' ' A' ' 92' ' ' ARG . 14.7 t70 -74.0 -23.12 59.39 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 122.066 0.936 . . . . 3.12 110.371 177.113 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.853 ' O ' HG23 ' A' ' 95' ' ' VAL . . . 131.03 -38.7 1.89 Allowed Glycine 0 N--CA 1.436 -1.307 0 CA-C-N 114.037 -1.438 . . . . 2.31 110.245 177.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.853 HG23 ' O ' ' A' ' 94' ' ' GLY . 2.7 t 172.88 135.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.347 0.488 0 C-N-CA 126.96 2.104 . . . . 1.06 108.388 160.075 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.831 ' H ' ' HG2' ' A' ' 99' ' ' ARG . 8.6 m-20 -111.35 147.14 35.79 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.431 -0.581 . . . . 2.12 109.431 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.563 ' CE3' ' HA ' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -54.51 -46.49 73.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.188 0.518 . . . . 3.34 110.581 177.437 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 1.005 ' HA3' HG12 ' B' 1015 ' ' ILE . . . -79.32 -19.57 71.49 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.925 -0.655 . . . . 0.69 112.872 -178.412 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.831 ' HG2' ' H ' ' A' ' 96' ' ' ASN . 0.1 OUTLIER -72.45 -28.74 63.13 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.73 -0.47 . . . . 4.24 109.73 -179.354 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 77.5 mt -65.27 -38.52 82.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.76 -0.459 . . . . 0.44 109.76 177.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.464 ' HA ' ' CD1' ' A' ' 104' ' ' PHE . 2.0 m -69.66 -34.69 62.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 116.134 -0.484 . . . . 1.35 109.93 175.218 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.514 ' HB2' ' HE2' ' A' ' 57' ' ' PHE . . . -63.23 -49.34 74.52 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.558 0.694 . . . . 0.44 110.078 175.696 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -55.13 -49.11 72.59 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.313 -1.312 . . . . 1.49 111.715 -179.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.587 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 0.2 OUTLIER -77.27 -26.59 52.57 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.489 -0.484 . . . . 3.29 110.832 -176.336 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.696 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 29.2 t -73.55 -49.42 26.53 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.109 0.48 . . . . 1.19 110.197 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.495 ' HZ ' HD11 ' A' ' 72' ' ' LEU . 29.2 t80 -71.2 -24.89 62.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.893 -0.594 . . . . 2.89 109.802 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.403 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -68.19 -43.25 81.1 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.804 -0.712 . . . . 0.3 111.334 172.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.834 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.61 -32.41 84.08 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.77 -0.729 . . . . 0.23 111.319 174.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.58 -30.02 61.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.827 0.346 . . . . 0.31 110.639 175.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.548 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.8 -41.18 97.96 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 107.988 -1.116 . . . . 1.12 107.988 -179.634 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.691 ' SG ' HG22 ' A' ' 123' ' ' VAL . 25.0 t -52.58 -54.55 31.47 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.468 -1.696 . . . . 0.26 110.904 173.263 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.405 HG11 ' HD3' ' A' ' 20' ' ' LYS . 68.9 t -64.37 -41.25 91.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 0.35 111.588 -177.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.51 ' HB3' HG21 ' A' ' 74' ' ' ILE . 1.4 mm-40 -60.62 -25.03 65.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.035 0.445 . . . . 2.51 110.746 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.454 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 50.6 m -77.14 -40.59 45.05 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 108.896 -0.779 . . . . 0.28 108.896 174.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 111' ' ' CYS . 98.2 t -64.47 -35.42 74.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.095 -0.957 . . . . 1.23 109.461 -179.613 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -50.17 -50.89 47.67 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 113.582 -1.645 . . . . 0.6 111.129 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.406 ' HB2' ' HG3' ' A' ' 119' ' ' MET . 12.8 mmtp -87.2 14.1 8.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.703 -0.68 . . . . 1.62 110.621 -179.188 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 66.1 38.34 4.8 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.443 0.639 . . . . 1.88 110.308 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.465 ' HB3' HD23 ' A' ' 122' ' ' LEU . 24.7 mtm -117.71 50.16 1.16 Allowed 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.551 -0.907 . . . . 0.31 108.551 -178.502 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.417 ' HA ' HG23 ' A' ' 123' ' ' VAL . 0.8 OUTLIER -65.63 -7.1 13.35 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.725 -1.125 . . . . 1.15 112.285 -176.116 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.531 HG23 HD22 ' A' ' 122' ' ' LEU . 30.0 m -68.04 -20.54 25.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.616 0.246 . . . . 0.46 111.349 173.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.724 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -76.39 -27.18 56.25 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 110.216 -0.29 . . . . 0.26 110.216 177.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.691 HG22 ' SG ' ' A' ' 111' ' ' CYS . 56.3 t -44.69 -53.15 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 O-C-N 123.986 0.804 . . . . 0.25 112.162 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.604 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 1.5 p -69.93 -39.42 76.14 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-O 120.86 0.362 . . . . 1.35 111.587 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.724 ' HD2' HD13 ' A' ' 122' ' ' LEU . 92.2 mtt180 -62.15 -55.5 28.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.571 -0.74 . . . . 2.67 110.183 -177.252 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.622 ' HA ' ' CE2' ' A' ' 129' ' ' TRP . 77.9 mt -51.93 -51.14 30.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.512 -0.767 . . . . 0.23 111.177 -179.645 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.66 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.81 -25.57 63.29 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.804 0.298 . . . . 0.29 111.804 -178.608 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.965 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -67.35 -63.88 0.97 Allowed 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.131 0.491 . . . . 0.28 110.089 -178.34 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' TRP . . . . . 0.622 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 24.1 p-90 -78.1 -16.72 57.74 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 115.304 -0.862 . . . . 3.91 112.059 -174.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.607 ' SD ' HG22 ' A' ' 126' ' ' ILE . 81.7 mtp -59.39 -54.35 47.77 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.144 -0.622 . . . . 1.08 109.822 169.698 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.47 -38.29 77.67 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.763 -0.653 . . . . 0.25 110.689 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.606 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 56.7 m -60.92 -43.34 98.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 121.062 -0.255 . . . . 0.4 111.378 175.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.477 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 82.7 t80 -59.71 -43.09 94.28 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.963 -0.384 . . . . 3.13 109.963 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.717 HD13 ' HB2' ' A' ' 5' ' ' ASN . 5.4 tt -60.62 -47.62 85.42 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.734 -0.839 . . . . 0.95 108.734 174.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 135' ' ' ASN . . . . . 0.441 ' OD1' ' HB2' ' A' ' 2' ' ' SER . 2.8 m-80 -48.37 -58.59 4.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.663 -0.699 . . . . 0.46 112.394 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -81.39 -45.56 15.92 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.197 0.443 . . . . 0.59 112.197 -173.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' HIS . . . . . 0.477 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 1.6 m-70 -90.64 -50.14 6.09 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.744 0.646 . . . . 1.45 112.744 -170.751 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.62 HD21 ' NH2' ' A' ' 99' ' ' ARG . 59.9 mt -89.33 -39.03 13.72 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 113.44 0.904 . . . . 1.2 113.44 -165.554 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.648 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 32.1 tt0 -50.81 -52.45 57.01 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-O 119.134 -0.46 . . . . 0.75 112.098 -172.687 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.637 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.1 Cg_exo -53.85 -51.71 10.11 Favored 'Trans proline' 0 C--N 1.358 1.049 0 C-N-CA 121.772 1.648 . . . . 0.56 111.505 176.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' TRP . . . . . 0.505 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 8.4 t-105 -55.14 -51.9 64.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.186 -0.915 . . . . 1.2 110.678 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.602 HD12 ' HA ' ' A' ' 139' ' ' GLU . 59.7 mt -46.85 -53.06 3.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.884 -0.598 . . . . 0.32 111.654 172.645 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.648 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 76.3 mm-40 -62.18 -29.87 70.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.085 -0.507 . . . . 0.57 111.675 -178.235 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.637 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 11.6 mm-40 -63.95 -20.57 65.97 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.611 0.72 . . . . 0.78 110.437 175.015 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -104.1 0.94 30.28 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.072 -0.967 . . . . 0.93 109.019 -175.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 124.8 -46.24 1.1 Allowed Glycine 0 N--CA 1.441 -1.028 0 CA-C-N 114.85 -1.068 . . . . 0.56 112.299 178.094 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' GLY . . . . . 0.429 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 135.03 178.21 15.51 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.238 -0.745 . . . . 0.49 111.238 -177.492 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.688 ' HB2' ' OE1' ' A' ' 42' ' ' GLU . 5.2 m-90 -63.5 -37.66 88.17 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 117.056 0.428 . . . . 3.57 110.412 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 20.7 m-20 -52.85 -43.9 66.39 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.211 0.529 . . . . 1.96 110.203 176.243 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.574 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 89.2 m -60.24 -37.82 81.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.211 -0.904 . . . . 0.67 111.95 -175.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.438 ' CE2' HD12 ' A' ' 50' ' ' LEU . 84.7 t80 -62.97 -38.46 91.19 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.402 -0.519 . . . . 3.0 109.989 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.643 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.5 m -74.67 -24.57 18.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.222 0.534 . . . . 1.15 109.774 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 36.2 mm-40 -64.35 -25.49 68.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.201 0.524 . . . . 1.67 110.081 173.042 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.0 mt -96.03 -57.42 2.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.697 -0.683 . . . . 1.3 110.476 178.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -120.36 28.82 7.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.561 -0.745 . . . . 4.24 111.279 -170.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.779 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -60.94 167.69 10.84 Favored Glycine 0 CA--C 1.501 -0.817 0 CA-C-N 115.576 -0.738 . . . . 1.1 113.258 179.257 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.557 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 28.8 t-20 -56.65 114.94 2.26 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 113.994 -1.103 . . . . 1.29 111.49 -178.265 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.693 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 9.5 m120 -72.11 -27.53 62.69 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.146 0.424 . . . . 2.99 112.146 -173.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -57.53 -38.52 74.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.206 0.527 . . . . 2.52 110.224 175.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.443 ' HB1' ' NH2' ' A' ' 164' ' ' ARG . . . -88.34 -36.75 16.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.818 -0.628 . . . . 2.87 110.706 176.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.693 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -58.66 -55.97 28.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.209 -0.451 . . . . 3.2 111.537 -178.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -66.6 -25.39 66.59 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.465 -0.334 . . . . 3.72 110.958 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 23.3 t -69.74 -44.88 69.34 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.77 -0.456 . . . . 4.18 109.77 176.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 164' ' ' ARG . . . . . 0.443 ' NH2' ' HB1' ' A' ' 160' ' ' ALA . 0.2 OUTLIER -68.48 -32.05 71.77 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.982 0.42 . . . . 5.82 110.403 176.596 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -59.58 -38.57 81.53 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.189 -0.914 . . . . 4.77 110.303 178.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -59.97 -47.61 90.14 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 115.657 -0.701 . . . . 5.1 112.678 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -80.25 -21.27 42.95 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.913 0.387 . . . . 5.72 110.793 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.405 ' O ' ' HD2' ' A' ' 172' ' ' HIS . 29.2 tt0 -70.17 -17.13 63.16 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.436 -0.579 . . . . 5.88 109.436 175.59 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.42 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 0.3 OUTLIER -67.05 -34.58 77.99 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.805 -0.813 . . . . 7.34 108.805 178.89 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 170' ' ' LEU . 4.0 mm? -82.54 -14.19 55.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.179 -0.919 . . . . 6.97 110.151 178.145 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -81.22 -44.09 18.3 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.476 -0.784 . . . . 6.97 109.627 176.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 172' ' ' HIS . . . . . 0.405 ' HD2' ' O ' ' A' ' 168' ' ' GLU . 57.3 m-70 -60.89 -35.29 76.27 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.007 -0.542 . . . . 9.35 110.589 177.743 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -90.17 91.08 8.38 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.567 -0.531 . . . . 11.4 109.567 174.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 72.3 m-70 -80.34 174.66 11.38 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.054 -0.521 . . . . 11.52 110.455 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -59.66 151.31 25.18 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.084 -0.507 . . . . 14.48 110.094 175.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -63.35 140.94 58.92 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.43 -0.35 . . . . 15.37 110.208 -178.492 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 71.6 m80 -68.27 -43.32 78.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.334 -0.394 . . . . 16.02 110.19 179.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 92.6 mt 59.9 -175.21 0.1 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.82 -0.627 . . . . 17.99 111.861 177.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 59.52 82.66 0.15 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.533 -0.758 . . . . 19.19 111.44 177.271 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 64.3 m80 62.66 27.42 16.14 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.724 -0.671 . . . . 22.26 111.658 176.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -89.71 129.97 36.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.451 -0.341 . . . . 22.51 110.356 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -98.94 170.66 8.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.24 -0.437 . . . . 24.89 110.853 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 42.2 m80 -68.06 125.36 26.09 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.048 -0.524 . . . . 25.58 110.79 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -60.29 -30.41 69.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.951 -0.568 . . . . 27.37 110.476 177.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 46.2 t-80 . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.602 -0.713 . . . . 29.06 109.615 178.52 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.17 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -71.39 131.0 19.19 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.856 -0.687 . . . . 2.97 112.384 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.568 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . 62.7 m 61.2 -120.65 0.8 Allowed 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 122.357 0.263 . . . . 1.94 110.905 -179.118 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.959 HG23 ' H ' ' B' 1005 ' ' GLY . 30.4 m 40.22 -88.89 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 125.151 1.38 . . . . 1.63 113.902 174.152 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 1005 ' ' GLY . . . . . 0.959 ' H ' HG23 ' B' 1004 ' ' VAL . . . -38.73 -33.7 0.23 Allowed Glycine 0 CA--C 1.529 0.918 0 CA-C-N 118.505 0.593 . . . . 1.2 113.416 169.338 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 1006 ' ' ARG . . . . . 0.548 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 6.4 mpt_? -83.3 -56.86 3.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.003 0.43 . . . . 2.88 111.133 174.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 1007 ' ' ALA . . . . . 0.653 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -67.83 -54.98 14.74 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.895 0.702 . . . . 1.31 112.895 -169.677 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.76 ' HG ' HG13 ' A' ' 86' ' ' VAL . 3.0 mm? -58.44 -53.64 56.01 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.227 0.329 . . . . 1.33 110.965 -175.378 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 1009 ' ' ALA . . . . . 1.104 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -47.65 -45.74 28.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.701 0.762 . . . . 0.88 110.848 176.791 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.789 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -67.12 -54.45 21.23 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.303 -1.317 . . . . 1.03 111.406 -177.086 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.601 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 58.7 m-85 -66.71 -17.1 64.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.516 . . . . 1.67 110.528 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -83.94 -3.99 88.85 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.863 -0.608 . . . . 0.78 113.467 -176.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -93.56 3.9 54.8 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.645 0.736 . . . . 1.9 109.796 176.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 34.4 m -97.14 28.25 3.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.668 -0.696 . . . . 1.44 111.687 -175.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1015 ' ' ILE . . . . . 1.005 HG12 ' HA3' ' A' ' 98' ' ' GLY . 0.5 OUTLIER -76.22 72.32 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.988 0.423 . . . . 2.91 110.797 176.399 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 15.8 m120 -128.32 131.8 48.64 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.836 -0.62 . . . . 4.29 110.03 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -116.41 86.01 2.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.304 -0.407 . . . . 8.17 110.49 -176.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.634 0 CA-C-N 116.523 -0.308 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.789 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 110.081 -0.34 . . . . 6.21 110.081 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.9 p 49.31 27.85 2.06 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.766 0.826 . . . . 1.87 112.88 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.428 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 42.1 tp60 -90.81 0.81 57.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.682 0.753 . . . . 2.42 109.546 179.098 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.446 ' CB ' ' HG2' ' A' ' 42' ' ' GLU . 0.9 OUTLIER -72.78 -3.97 28.65 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.097 -0.956 . . . . 1.25 110.852 -178.427 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.554 ' HB2' ' HG ' ' A' ' 134' ' ' LEU . 3.3 p30 -62.97 -26.66 68.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.986 -0.552 . . . . 1.78 111.218 177.418 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.829 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.9 tpp180 -51.52 -49.87 61.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.05 -0.523 . . . . 1.4 110.506 173.692 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.813 ' HB3' ' HE3' ' A' ' 47' ' ' LYS . 53.1 mt-10 -50.49 -52.74 35.56 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.964 -1.017 . . . . 0.68 112.066 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.65 HD11 HG22 ' A' ' 46' ' ' VAL . 1.2 mp -50.71 -31.47 16.59 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.913 0.885 . . . . 1.16 112.094 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.482 HG13 ' HE2' ' A' ' 130' ' ' MET . 96.3 t -80.35 -60.35 2.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-O 121.48 0.657 . . . . 0.27 110.023 174.277 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 6' ' ' ARG . 46.4 t -53.37 -54.2 19.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 114.79 -1.095 . . . . 0.33 112.755 -174.205 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -57.25 -36.53 71.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.128 0.489 . . . . 0.59 110.316 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.704 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -66.31 -53.54 35.33 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.633 -0.712 . . . . 1.61 109.985 179.246 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 1.015 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.7 mp -60.68 -38.5 85.15 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 120.699 0.285 . . . . 0.34 110.827 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.515 ' HA ' ' CB ' ' A' ' 24' ' ' TRP . 27.0 t -60.67 -37.05 80.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.17 0.51 . . . . 1.05 110.677 177.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -77.07 -23.81 51.92 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.975 -0.557 . . . . 1.22 110.252 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.795 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 8.8 mmpt? -81.67 -39.94 23.6 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.281 -0.418 . . . . 1.41 111.648 -177.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.593 HD23 ' HA ' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -61.99 -27.84 69.15 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 119.926 -0.709 . . . . 1.35 110.183 176.294 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.7 t -75.04 -13.9 60.54 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.526 -0.761 . . . . 0.94 111.337 -177.517 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.795 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 20.7 pt20 -81.01 -9.39 59.85 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.388 0.613 . . . . 1.37 111.883 -177.28 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.802 ' HZ3' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -120.02 -20.3 7.52 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 122.048 0.928 . . . . 2.2 109.646 178.828 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.65 29.98 5.4 Favored Glycine 0 C--N 1.305 -1.18 0 CA-C-N 113.869 -1.514 . . . . 0.53 112.799 175.422 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -109.82 169.69 8.55 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.715 0.293 . . . . 0.76 110.909 168.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.5 t -105.27 150.19 25.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.153 0.501 . . . . 0.52 110.843 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.593 ' HA ' HD23 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -81.11 -43.79 18.91 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.346 -0.843 . . . . 3.36 110.032 172.88 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.452 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 7.0 p -71.21 -23.51 62.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.971 -0.559 . . . . 1.37 111.564 -172.167 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -65.15 -27.26 68.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.902 0.382 . . . . 1.11 110.966 175.126 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -122.28 16.56 10.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.05 -0.523 . . . . 1.28 112.21 -174.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.452 ' OG ' ' HA ' ' A' ' 25' ' ' SER . 90.2 p -100.61 -179.23 4.03 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.88 0.696 . . . . 1.81 112.88 -172.822 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.544 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.9 t70 -168.59 -24.19 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.324 -1.307 . . . . 2.31 109.806 178.716 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.832 HG23 ' H ' ' A' ' 31' ' ' GLU . 9.2 m -47.48 -70.95 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 114.912 -1.04 . . . . 0.92 113.08 -171.646 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.832 ' H ' HG23 ' A' ' 30' ' ' VAL . 9.3 pt-20 -100.82 2.43 41.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.721 0.772 . . . . 2.74 109.054 175.416 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.544 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 29.5 tt0 -70.59 -59.02 3.07 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 114.624 -1.171 . . . . 1.45 111.127 -177.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -94.18 -41.62 9.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.981 -0.554 . . . . 1.87 111.038 -173.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.527 ' HG2' ' O ' ' A' ' 30' ' ' VAL . 9.4 ptp180 -96.75 152.13 18.97 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.472 -0.566 . . . . 3.39 109.472 177.522 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.5 p -128.68 104.23 7.53 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-O 121.665 0.745 . . . . 2.25 111.028 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -104.98 -75.72 0.62 Allowed 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.913 -1.04 . . . . 3.34 108.927 -178.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.428 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . . . -100.71 153.9 37.47 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.435 -0.802 . . . . 1.92 109.672 173.744 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.732 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 54.0 Cg_exo -52.93 162.39 2.65 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 C-N-CA 122.848 2.365 . . . . 1.87 112.581 173.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -76.92 1.31 18.02 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.315 -0.402 . . . . 4.64 111.048 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.729 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 179.18 66.93 0.07 OUTLIER Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 121.028 -0.606 . . . . 2.15 112.025 177.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.802 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.5 t -90.03 -76.02 0.44 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 120.351 -0.54 . . . . 1.12 111.482 -177.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.802 ' H ' HG23 ' A' ' 41' ' ' THR . 11.9 pt-20 -94.56 -30.58 14.3 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-O 122.152 0.977 . . . . 2.02 110.376 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.932 ' HA ' HG13 ' A' ' 46' ' ' VAL . 58.5 m -75.66 -17.85 59.84 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.725 -1.58 . . . . 1.25 114.372 -166.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.583 ' HA ' ' CD ' ' A' ' 47' ' ' LYS . 39.4 tt0 -45.68 -47.02 15.09 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 118.237 0.471 . . . . 1.91 111.113 -177.316 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.64 -46.03 64.06 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.721 0.267 . . . . 0.52 111.721 175.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.932 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.9 m -67.1 -35.47 74.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 120.946 0.403 . . . . 1.41 111.309 -175.862 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.813 ' HE3' ' HB3' ' A' ' 7' ' ' GLU . 6.8 ptmt -77.66 -32.29 53.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.963 -0.754 . . . . 0.67 108.963 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.611 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 5.6 mm-40 -66.08 -30.47 70.99 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.719 -0.673 . . . . 0.99 110.131 173.512 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.641 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -76.95 -42.66 38.3 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.233 0.54 . . . . 0.42 111.077 176.638 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.561 HD21 ' HD2' ' A' ' 104' ' ' PHE . 1.3 tp -66.29 -25.1 66.7 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.621 -0.718 . . . . 1.33 112.486 -173.125 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.579 ' HD2' ' OE1' ' A' ' 48' ' ' GLN . 8.9 ptp180 -81.33 -28.42 34.55 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 109.069 -0.715 . . . . 2.17 109.069 -175.597 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 10.8 mm-40 -74.2 -49.17 24.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.546 -1.206 . . . . 1.1 109.38 176.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.65 -39.35 88.01 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.483 -0.78 . . . . 0.53 110.092 174.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.67 ' HA3' ' HZ ' ' A' ' 12' ' ' PHE . . . -63.91 -43.88 96.87 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.59 -0.732 . . . . 0.7 112.047 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.615 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 32.6 t70 -58.14 -43.74 87.47 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.691 0.281 . . . . 1.04 110.256 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 52' ' ' GLU . 78.0 mm-40 -58.19 -28.3 64.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.687 -0.688 . . . . 2.29 111.381 177.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -81.69 -44.54 16.98 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.919 -0.582 . . . . 2.29 110.83 176.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.654 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 37.4 mt-10 -61.96 -63.2 1.33 Allowed 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.833 -0.621 . . . . 1.3 112.007 -172.415 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.713 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -48.9 -34.25 12.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.999 0.74 . . . . 1.54 112.999 -173.738 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.713 ' H ' HD12 ' A' ' 59' ' ' LEU . 71.5 mtt-85 -62.88 -61.6 2.29 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.109 0.481 . . . . 2.58 111.45 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -92.05 -3.61 55.55 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.827 -0.624 . . . . 5.32 112.073 -173.078 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -49.93 -29.58 8.62 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 113.047 0.758 . . . . 4.48 113.047 -175.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.9 mtp180 -54.32 -34.08 60.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.799 0.333 . . . . 4.72 111.741 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.641 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -88.72 -26.6 21.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.491 -0.322 . . . . 1.17 111.418 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.605 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 39.0 t80 -46.83 -45.99 20.52 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.557 0.577 . . . . 2.81 112.557 -173.655 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.4 p -69.0 -24.92 64.28 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.848 0.356 . . . . 2.19 111.629 -175.057 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -90.57 -29.77 17.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.482 -0.326 . . . . 2.72 111.182 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.665 ' O ' HD12 ' A' ' 72' ' ' LEU . 18.8 mt -61.55 -22.77 65.46 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 112.589 0.589 . . . . 1.56 112.589 -173.293 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.624 HG22 HG13 ' A' ' 74' ' ' ILE . 15.8 p -58.68 -23.31 59.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 0.7 110.956 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 7.6 t -77.66 -38.99 46.49 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.903 -0.59 . . . . 1.34 109.64 176.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.46 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 46.1 mt-30 -65.15 -54.45 29.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.691 -0.686 . . . . 1.42 109.837 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.665 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.2 mp -66.36 -30.48 70.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.452 -0.794 . . . . 1.37 110.129 179.256 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 63.71 59.83 1.13 Allowed 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 122.167 0.984 . . . . 2.72 108.474 -175.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.624 HG13 HG22 ' A' ' 69' ' ' THR . 17.2 mm -57.82 122.96 8.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 113.789 -1.55 . . . . 0.91 111.01 -178.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.749 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -157.34 -172.82 0.34 Allowed Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 108.021 -1.104 . . . . 0.51 108.021 -168.825 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.749 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 34.9 Cg_exo -29.63 165.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 125.119 3.879 . . . . 0.47 115.266 165.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.435 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.56 -29.9 0.01 OUTLIER Glycine 0 N--CA 1.473 1.151 0 N-CA-C 117.33 1.692 . . . . 0.4 117.33 -174.034 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 76' ' ' PRO . 39.4 p -71.66 11.08 0.54 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 117.79 0.795 . . . . 0.56 111.938 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.01 -13.17 61.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.246 0.546 . . . . 0.34 109.736 172.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -78.79 -14.57 59.19 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.173 -0.677 . . . . 4.13 109.173 175.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.433 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 53.5 mt-30 -84.52 -20.87 30.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.828 0.823 . . . . 1.03 109.917 172.612 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.595 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 6.5 m -80.02 -48.64 12.99 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 114.575 -1.193 . . . . 0.48 108.828 169.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -62.75 -17.43 60.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.887 -1.051 . . . . 1.18 109.915 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.645 ' HA ' HG12 ' A' ' 87' ' ' VAL . 34.7 tt0 -60.49 -50.44 73.53 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.458 -0.792 . . . . 0.8 110.579 177.437 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -47.47 -35.14 8.22 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.01 -0.995 . . . . 1.62 110.702 176.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.643 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.6 t -81.83 -51.38 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.978 0 CA-C-N 114.485 -1.234 . . . . 1.3 110.7 -177.111 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.645 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.8 p -61.58 -23.9 32.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-O 121.554 0.692 . . . . 0.85 109.731 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.427 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 1.8 m-80 -71.99 -40.74 68.34 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.402 -1.272 . . . . 0.91 111.977 176.433 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 1.03 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.3 pp20? -73.23 -29.43 62.78 Favored 'General case' 0 CA--C 1.495 -1.149 0 CA-C-O 121.699 0.761 . . . . 2.87 109.127 177.104 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.691 ' HG ' ' HD3' ' A' ' 99' ' ' ARG . 0.1 OUTLIER -71.05 -32.52 69.27 Favored 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.556 -1.202 . . . . 1.28 111.619 -168.158 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.427 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 2.3 p90 -107.47 11.69 28.59 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.108 0.48 . . . . 2.3 110.859 -172.419 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.911 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -54.42 -34.53 61.53 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.685 -0.689 . . . . 5.06 112.553 -177.789 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.649 ' HB3' ' OD1' ' A' ' 96' ' ' ASN . 15.4 t70 -84.48 -18.76 34.8 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 122.101 0.953 . . . . 3.12 110.239 176.787 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.866 ' O ' HG23 ' A' ' 95' ' ' VAL . . . 130.95 -40.0 1.71 Allowed Glycine 0 N--CA 1.44 -1.037 0 CA-C-N 114.234 -1.348 . . . . 2.31 110.918 173.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.866 HG23 ' O ' ' A' ' 94' ' ' GLY . 2.9 t 173.36 110.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.349 0.566 0 C-N-CA 127.022 2.129 . . . . 1.06 108.15 160.531 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.805 ' HB2' ' HB3' ' A' ' 99' ' ' ARG . 2.1 m-20 -83.91 152.83 24.3 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.753 -0.462 . . . . 2.12 109.753 -177.023 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.54 ' HH2' ' HB2' ' A' ' 155' ' ' TYR . 84.9 t90 -59.04 -52.84 64.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.272 0.558 . . . . 3.34 110.111 178.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 1.055 ' HA3' HG12 ' B' 1015 ' ' ILE . . . -77.41 -16.34 80.5 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.646 -0.706 . . . . 0.69 112.698 -177.45 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.805 ' HB3' ' HB2' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -72.51 -29.26 63.45 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.535 -0.542 . . . . 4.24 109.535 -179.635 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 33.0 mt -63.3 -45.11 99.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 109.394 -0.595 . . . . 0.44 109.394 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.436 HG13 ' HA2' ' A' ' 98' ' ' GLY . 1.8 m -62.6 -39.33 84.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.827 -0.624 . . . . 1.35 109.648 175.646 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.24 -44.86 94.02 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 121.087 0.47 . . . . 0.44 111.04 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -58.66 -42.06 87.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.289 -0.869 . . . . 1.49 110.956 -179.213 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.651 ' HZ ' ' HB2' ' A' ' 134' ' ' LEU . 28.9 m-85 -80.63 -30.18 36.71 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.671 0.272 . . . . 3.29 111.145 179.229 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.59 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 48.0 t -63.65 -56.23 17.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.153 -0.476 . . . . 1.19 110.222 176.003 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.448 ' HA ' ' HB3' ' A' ' 109' ' ' ALA . 32.7 t80 -74.31 -26.34 60.11 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.928 -0.578 . . . . 2.89 110.364 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.99 -45.59 86.68 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.336 -0.935 . . . . 0.3 111.016 173.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 1.015 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.5 -29.42 74.78 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 111.11 -0.796 . . . . 0.23 111.11 174.399 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.605 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -71.51 -34.54 70.19 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.983 -0.377 . . . . 0.31 109.983 176.643 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.486 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.3 OUTLIER -67.55 -34.88 77.97 Favored 'General case' 0 CA--C 1.506 -0.741 0 CA-C-O 121.892 0.853 . . . . 1.12 109.781 -179.267 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.698 ' SG ' HG13 ' A' ' 123' ' ' VAL . 44.2 t -51.25 -50.73 58.65 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.295 -1.321 . . . . 0.26 109.271 170.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.802 HG13 ' HZ3' ' A' ' 20' ' ' LYS . 86.3 t -63.84 -38.19 81.69 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 CA-C-N 116.252 -0.431 . . . . 0.35 110.514 175.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.489 ' HB3' HG13 ' A' ' 74' ' ' ILE . 42.8 mt-10 -56.12 -33.19 64.91 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.977 0.418 . . . . 2.51 110.552 176.168 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.461 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 25.1 m -79.73 -41.65 26.24 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.006 -0.543 . . . . 0.28 109.557 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 111' ' ' CYS . 99.3 t -68.74 -31.01 49.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.827 0.822 . . . . 1.23 109.739 -175.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -55.61 -47.9 75.8 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.015 -1.448 . . . . 0.6 110.858 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 23.8 mmtt -90.2 14.42 12.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.678 -0.692 . . . . 1.62 110.325 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 62.25 43.78 8.16 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.74 0.781 . . . . 1.88 111.278 -179.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.465 ' HB3' HD23 ' A' ' 122' ' ' LEU . 32.8 mtm -115.96 49.33 1.12 Allowed 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.645 -1.242 . . . . 0.31 107.645 178.616 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.432 ' H ' ' CD ' ' A' ' 120' ' ' GLN . 6.4 mp0 -67.85 -6.72 22.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.182 -1.372 . . . . 1.15 112.455 -171.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.469 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 27.0 m -72.52 -12.79 16.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.935 0.398 . . . . 0.46 111.211 175.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.71 HD13 ' HD3' ' A' ' 125' ' ' ARG . 2.9 mm? -83.62 -24.09 31.58 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 109.776 -0.453 . . . . 0.26 109.776 176.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.698 HG13 ' SG ' ' A' ' 111' ' ' CYS . 67.4 t -46.9 -55.58 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.783 -0.644 . . . . 0.25 112.223 -178.31 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 12.8 t -73.88 -31.41 63.13 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.729 -0.388 . . . . 1.35 110.142 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.71 ' HD3' HD13 ' A' ' 122' ' ' LEU . 11.8 mtp180 -61.23 -58.66 7.37 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 120.859 0.362 . . . . 2.67 110.639 178.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.661 HG22 ' SD ' ' A' ' 130' ' ' MET . 71.2 mt -51.77 -52.62 21.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.545 -0.752 . . . . 0.23 110.043 179.257 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.802 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.19 -36.31 68.23 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.945 0.402 . . . . 0.29 111.627 179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.829 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -63.59 -59.64 4.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.219 0.533 . . . . 0.28 110.499 176.749 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 68.7 m95 -67.36 -22.74 65.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.887 -1.051 . . . . 3.91 111.504 -174.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.661 ' SD ' HG22 ' A' ' 126' ' ' ILE . 85.9 mtp -69.24 -54.11 16.44 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.679 0.276 . . . . 1.08 111.244 175.068 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.456 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -67.11 -33.17 74.89 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.506 -0.316 . . . . 0.25 110.844 -177.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 97.6 m -63.8 -45.14 91.04 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.672 -0.411 . . . . 0.4 110.884 175.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -57.91 -41.97 83.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.034 0.445 . . . . 3.13 110.04 176.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.94 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.5 OUTLIER -57.38 -58.11 9.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.728 -0.669 . . . . 0.95 109.663 172.242 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -45.22 -55.28 5.98 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.036 -0.984 . . . . 0.46 112.631 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -76.21 -53.33 8.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.994 0.426 . . . . 0.59 111.853 -173.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.79 -50.27 5.83 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.774 0.657 . . . . 1.45 112.774 -169.241 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.94 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -76.55 -47.35 22.88 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 113.629 0.974 . . . . 1.2 113.629 -167.453 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.594 ' HA ' HD12 ' A' ' 142' ' ' ILE . 18.7 tt0 -45.24 -52.36 21.4 Favored Pre-proline 0 CA--C 1.538 0.511 0 O-C-N 123.965 0.791 . . . . 0.75 112.785 -170.815 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.555 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 31.3 Cg_exo -58.52 -45.21 31.52 Favored 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 121.704 1.603 . . . . 0.56 111.689 178.441 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' TRP . . . . . 0.679 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.8 OUTLIER -58.78 -52.07 67.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.174 -0.921 . . . . 1.2 110.846 179.137 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.595 HD13 ' NE1' ' A' ' 148' ' ' TRP . 59.1 mt -45.62 -52.52 2.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.661 -0.7 . . . . 0.32 111.768 175.482 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.573 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.7 mm-40 -58.32 -34.44 70.6 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.812 -0.631 . . . . 0.57 111.34 -179.401 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 10.8 mm-40 -64.03 -22.9 67.12 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.118 0.485 . . . . 0.78 111.103 177.012 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -100.9 -7.45 23.45 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.655 -0.702 . . . . 0.93 109.575 -173.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 134.99 -36.96 2.0 Allowed Glycine 0 N--CA 1.44 -1.034 0 CA-C-N 115.358 -0.837 . . . . 0.56 112.772 176.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 120.16 175.22 15.55 Favored Glycine 0 N--CA 1.449 -0.44 0 N-CA-C 111.146 -0.781 . . . . 0.49 111.146 -175.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.595 ' NE1' HD13 ' A' ' 142' ' ' ILE . 4.8 m-90 -67.48 -33.72 75.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.339 0.569 . . . . 3.57 111.319 -176.603 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.413 ' O ' ' HG3' ' A' ' 153' ' ' GLU . 9.7 m-20 -58.98 -40.06 83.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.119 0.485 . . . . 1.96 110.233 177.767 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.536 ' O ' ' HB2' ' A' ' 153' ' ' GLU . 55.3 m -55.54 -37.33 67.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.392 -0.822 . . . . 0.67 112.224 177.393 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.425 ' HA ' ' HZ2' ' A' ' 97' ' ' TRP . 10.5 m-85 -61.47 -39.84 92.36 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.459 -0.497 . . . . 3.0 110.356 -178.652 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.755 HG12 ' HA ' ' A' ' 46' ' ' VAL . 0.8 OUTLIER -75.42 -26.11 18.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.074 -0.512 . . . . 1.15 110.004 177.764 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.536 ' HB2' ' O ' ' A' ' 150' ' ' THR . 70.2 mt-10 -58.08 -30.35 66.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.243 -0.435 . . . . 1.67 110.483 171.554 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.53 HD12 ' CE2' ' A' ' 97' ' ' TRP . 3.4 mt -98.65 -56.7 2.38 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.23 -0.441 . . . . 1.3 111.023 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 155' ' ' TYR . . . . . 0.541 ' OH ' ' HA ' ' B' 1016 ' ' ASN . 3.1 m-85 -120.59 28.47 7.96 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.174 -0.466 . . . . 4.24 111.098 -173.528 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.641 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -62.9 157.49 38.9 Favored Glycine 0 CA--C 1.498 -0.997 0 C-N-CA 120.654 -0.784 . . . . 1.1 112.699 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.611 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 20.1 t-20 -54.18 113.88 1.41 Allowed 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 114.286 -0.957 . . . . 1.29 109.449 174.456 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.654 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 0.2 OUTLIER -91.8 2.61 56.39 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.725 -0.39 . . . . 2.99 111.441 -171.863 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -53.27 -42.5 66.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.65 0.262 . . . . 2.52 111.067 -178.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.573 ' O ' ' HD3' ' A' ' 164' ' ' ARG . . . -69.85 -38.97 76.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.46 -0.336 . . . . 2.87 110.891 176.691 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -54.21 -60.88 2.75 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.062 -0.517 . . . . 3.2 111.11 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.654 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 5.1 pt-20 -63.67 -33.73 76.27 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.72 -0.673 . . . . 3.72 111.651 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 163' ' ' SER . . . . . 0.509 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 29.7 t -61.32 -46.26 91.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.102 0.477 . . . . 4.18 110.32 178.266 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 164' ' ' ARG . . . . . 0.581 ' O ' ' HB2' ' A' ' 168' ' ' GLU . 9.2 mpt_? -79.24 -11.34 59.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.113 -0.494 . . . . 5.82 110.551 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -84.49 -45.5 12.58 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.828 -0.624 . . . . 4.77 110.32 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -64.41 -44.13 95.78 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.817 -0.629 . . . . 5.1 112.488 -179.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.509 ' HG2' ' O ' ' A' ' 163' ' ' SER . 4.2 pt20 -75.17 -15.18 60.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.944 0.402 . . . . 5.72 111.007 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.581 ' HB2' ' O ' ' A' ' 164' ' ' ARG . 29.2 tt0 -74.02 -10.04 59.23 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.424 0.63 . . . . 5.88 109.662 177.76 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.435 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 1.6 tmt_? -69.0 -37.08 78.51 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.831 -0.803 . . . . 7.34 108.831 174.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.454 HD22 ' HA ' ' A' ' 170' ' ' LEU . 0.3 OUTLIER -89.29 -46.2 8.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.699 -0.682 . . . . 6.97 109.199 177.497 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -73.98 92.1 2.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.861 -0.609 . . . . 6.97 109.527 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -68.69 156.11 38.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.087 -0.506 . . . . 9.35 111.034 -175.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -69.23 103.06 1.84 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.908 -0.587 . . . . 11.4 110.439 -177.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -85.8 -20.81 28.63 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.769 -0.65 . . . . 11.52 110.8 -177.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -73.69 123.65 24.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.168 0.508 . . . . 14.48 111.2 -176.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 28.8 t60 -80.8 112.66 18.39 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.463 -0.789 . . . . 15.37 109.515 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -87.18 122.0 30.38 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.978 -0.379 . . . . 16.02 109.978 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 55.8 tp -74.88 123.76 25.65 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.146 -0.479 . . . . 17.99 110.392 -178.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -113.4 159.16 19.75 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.394 -0.366 . . . . 19.19 110.338 177.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -69.49 133.22 47.43 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.127 0.489 . . . . 22.26 110.978 -177.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 29.2 m80 -98.98 -37.59 9.32 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.458 -0.941 . . . . 22.51 108.458 175.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -133.41 -69.52 0.55 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.95 -1.023 . . . . 24.89 109.042 171.564 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -167.64 127.53 1.38 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.628 -0.715 . . . . 25.58 109.843 176.484 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -88.83 137.94 31.86 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.159 -0.312 . . . . 27.37 110.159 179.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.6 m80 . . . . . 0 C--O 1.247 0.933 0 O-C-N 123.818 0.699 . . . . 29.06 110.241 -176.979 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.202 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -147.78 150.88 23.16 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.883 -0.675 . . . . 2.97 112.248 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.422 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . 18.7 m 56.2 -143.26 0.73 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 122.86 0.464 . . . . 1.94 110.88 -178.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.935 HG23 ' H ' ' B' 1005 ' ' GLY . 34.1 m 43.15 -92.16 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 124.815 1.246 . . . . 1.63 113.522 176.069 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1005 ' ' GLY . . . . . 1.008 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . -41.19 -31.6 0.56 Allowed Glycine 0 CA--C 1.534 1.223 0 CA-C-N 119.034 0.834 . . . . 1.2 113.588 168.143 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1006 ' ' ARG . . . . . 0.407 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 8.9 mpt_? -86.23 -52.32 5.72 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.462 -0.434 . . . . 2.88 111.344 171.751 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1007 ' ' ALA . . . . . 0.502 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -71.38 -55.02 8.79 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 113.012 0.745 . . . . 1.31 113.012 -170.017 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.701 HD23 ' HA ' ' B' 1004 ' ' VAL . 3.3 mm? -59.75 -56.52 20.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.584 -0.28 . . . . 1.33 110.679 -177.484 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1009 ' ' ALA . . . . . 1.03 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -41.18 -48.83 3.51 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.899 0.749 . . . . 0.88 111.578 173.591 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.802 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -65.19 -55.22 19.82 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 114.427 -1.26 . . . . 1.03 111.786 -177.022 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.633 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 49.7 m-85 -66.05 -24.92 66.83 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.024 0.44 . . . . 1.67 110.945 -178.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.44 -5.27 72.17 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.807 -0.633 . . . . 0.78 113.07 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 21.7 t70 -80.3 -20.73 43.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.264 0.554 . . . . 1.9 110.114 175.572 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 9.7 m -85.15 34.4 0.56 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.89 -0.595 . . . . 1.44 112.121 -172.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 1015 ' ' ILE . . . . . 1.055 HG12 ' HA3' ' A' ' 98' ' ' GLY . 1.3 pp -84.47 23.15 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 112.311 0.485 . . . . 2.91 112.311 179.319 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1016 ' ' ASN . . . . . 0.541 ' HA ' ' OH ' ' A' ' 155' ' ' TYR . 2.6 p-10 -161.35 -42.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 O-C-N 122.265 -0.272 . . . . 4.29 111.49 176.236 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1017 ' ' ARG . . . . . 0.402 HH11 ' HD3' ' B' 1017 ' ' ARG . 12.5 ttm180 -125.09 -86.8 0.62 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.764 0.316 . . . . 8.17 110.459 -178.536 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.434 0 O-C-N 122.381 -0.199 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.802 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.5 mtm . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 110.426 -0.213 . . . . 6.21 110.426 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.9 m 54.59 54.13 9.7 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.405 0.621 . . . . 1.87 111.185 -179.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.418 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 70.4 mm-40 -70.15 -9.48 55.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.674 -0.694 . . . . 2.42 111.141 -178.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.8 p -66.55 -18.99 65.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.107 -0.497 . . . . 1.25 111.473 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.656 ' HA ' HD22 ' A' ' 8' ' ' LEU . 11.8 m120 -64.27 -23.92 67.48 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.072 0.463 . . . . 1.78 110.19 176.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.969 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.2 tpp180 -56.88 -55.49 33.78 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.512 -0.767 . . . . 1.4 110.143 175.336 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.658 ' HB3' ' CE ' ' A' ' 47' ' ' LYS . 43.8 mt-10 -53.58 -49.93 66.69 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.409 -1.269 . . . . 0.68 111.434 -177.293 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.656 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.4 OUTLIER -51.91 -33.96 39.38 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.963 -1.017 . . . . 1.16 112.12 178.531 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.545 HG22 ' HE1' ' A' ' 104' ' ' PHE . 64.5 t -78.6 -59.35 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.719 0.771 . . . . 0.27 109.485 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.49 HG13 ' CE2' ' A' ' 24' ' ' TRP . 73.3 t -48.32 -57.32 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 114.223 -1.353 . . . . 0.33 113.099 -176.515 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -59.03 -31.77 69.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.698 0.285 . . . . 0.59 110.721 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.607 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.6 t80 -75.97 -44.62 38.94 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 116.265 -0.425 . . . . 1.61 110.444 -179.221 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.908 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.3 mp -60.43 -42.29 95.76 Favored 'General case' 0 CA--C 1.52 -0.185 0 C-N-CA 120.377 -0.529 . . . . 0.34 110.363 176.465 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.437 ' HA ' HD12 ' A' ' 17' ' ' LEU . 15.8 t -62.13 -40.2 95.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.097 -0.501 . . . . 1.05 109.89 177.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -59.71 -29.84 68.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.601 -0.727 . . . . 1.22 110.769 178.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.572 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 17.4 mmmt -78.6 -50.62 11.19 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.558 0.694 . . . . 1.41 110.506 -179.054 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.602 HD21 ' SG ' ' A' ' 111' ' ' CYS . 12.5 mt -56.52 -28.03 58.94 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 115.444 -0.798 . . . . 1.35 111.853 176.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.7 m -56.29 -44.67 80.06 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 112.362 0.504 . . . . 0.94 112.362 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 14.8 pt20 -75.46 0.12 18.23 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.31 0.576 . . . . 1.37 111.368 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.5 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.6 mmmt -109.53 -30.08 8.1 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.769 0.795 . . . . 2.2 109.199 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.99 24.06 9.35 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 114.134 -1.394 . . . . 0.53 111.139 178.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -115.2 160.5 19.65 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.079 0.466 . . . . 0.76 111.23 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.7 t -101.17 147.65 26.0 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.391 -0.822 . . . . 0.52 109.628 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.49 ' CE2' HG13 ' A' ' 10' ' ' VAL . 0.5 OUTLIER -79.31 -44.53 21.45 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.355 -0.609 . . . . 3.36 109.355 173.773 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.454 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 6.3 p -64.65 -32.94 74.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.384 -0.826 . . . . 1.37 111.76 -172.58 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -59.62 -24.29 63.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.136 0.493 . . . . 1.11 111.698 178.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.571 ' O ' ' HB2' ' A' ' 124' ' ' SER . 22.2 m-85 -120.46 13.57 11.82 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.898 -0.592 . . . . 1.28 110.897 -175.363 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.579 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 60.3 p -101.11 -178.53 3.77 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.923 0.712 . . . . 1.81 112.923 -170.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.599 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 4.2 t70 -170.54 -26.93 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.324 -1.307 . . . . 2.31 109.359 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.842 HG23 ' H ' ' A' ' 31' ' ' GLU . 10.7 m -45.16 -70.68 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-N 114.424 -1.262 . . . . 0.92 113.075 -173.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.842 ' H ' HG23 ' A' ' 30' ' ' VAL . 7.9 pt-20 -100.79 2.28 41.06 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.179 -0.675 . . . . 2.74 109.179 176.359 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.599 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.7 tt0 -68.34 -60.36 2.51 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.798 -1.092 . . . . 1.45 111.38 -175.4 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 48.1 m-80 -92.55 -36.99 12.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.149 -0.478 . . . . 1.87 111.1 -172.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.9 ptt180 -103.64 132.57 49.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.186 0.517 . . . . 3.39 110.401 175.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 29.9 p -113.34 113.59 25.46 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.668 -0.696 . . . . 2.25 110.988 -177.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -131.93 -64.51 0.78 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.484 -0.78 . . . . 3.34 110.65 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.418 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . . . -62.49 144.94 95.28 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.347 -0.842 . . . . 1.92 110.977 178.456 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.581 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 25.8 Cg_exo -63.87 177.26 1.93 Allowed 'Trans proline' 0 CA--C 1.529 0.242 0 C-N-CA 122.862 2.375 . . . . 1.87 112.007 176.106 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -81.48 13.46 3.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.481 0.657 . . . . 4.64 110.389 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 131.2 65.84 0.09 OUTLIER Glycine 0 N--CA 1.441 -1.013 0 CA-C-N 115.284 -0.871 . . . . 2.15 111.229 -178.031 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.876 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.6 t -66.77 -75.12 0.1 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.831 0.348 . . . . 1.12 110.313 -176.488 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.876 ' H ' HG23 ' A' ' 41' ' ' THR . 3.6 pt-20 -94.15 -28.87 15.44 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.281 1.039 . . . . 2.02 108.48 167.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.45 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.0 OUTLIER -56.34 -38.52 71.47 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 112.829 -1.987 . . . . 1.25 113.686 -169.826 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.508 ' HA ' ' CD ' ' A' ' 47' ' ' LYS . 13.8 tp10 -47.9 -56.1 8.33 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 117.903 0.319 . . . . 1.91 110.757 -174.218 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.512 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -66.14 -40.19 90.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.833 0.349 . . . . 0.52 110.743 178.096 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.761 ' HA ' HG12 ' A' ' 152' ' ' VAL . 84.8 t -56.75 -59.94 2.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.572 0.701 . . . . 1.41 111.134 178.554 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.658 ' CE ' ' HB3' ' A' ' 7' ' ' GLU . 4.2 ptmt -64.53 -30.77 71.8 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.811 -1.086 . . . . 0.67 109.837 -176.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.773 ' HB3' ' HB3' ' A' ' 157' ' ' ASN . 48.8 mm-40 -72.91 -27.35 61.81 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.566 -0.743 . . . . 0.99 110.882 177.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.659 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -79.7 -34.61 40.03 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.127 0.489 . . . . 0.42 109.814 175.254 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mp -62.73 -35.8 80.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.339 -0.846 . . . . 1.33 112.218 -178.031 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.422 ' HD3' ' OE1' ' A' ' 48' ' ' GLN . 11.6 ptm180 -68.99 -36.23 77.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.713 0.768 . . . . 2.17 109.585 178.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.559 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 6.6 mt-10 -80.74 -37.29 30.75 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.874 -1.057 . . . . 1.1 110.811 -174.198 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.42 -34.77 72.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.742 -0.663 . . . . 0.53 109.667 171.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.58 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.92 -50.69 61.55 Favored Glycine 0 C--O 1.223 -0.593 0 CA-C-N 115.342 -0.844 . . . . 0.7 112.431 179.043 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.607 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 28.1 t70 -54.29 -36.36 63.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.24 0.543 . . . . 1.04 111.099 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.533 ' O ' HD11 ' A' ' 59' ' ' LEU . 4.3 tt0 -76.98 -27.6 54.79 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.422 -0.808 . . . . 2.29 110.867 -178.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.485 ' CE1' ' HA2' ' B' 1012 ' ' GLY . 0.1 OUTLIER -82.87 -54.12 5.34 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.773 -0.649 . . . . 2.29 111.791 178.965 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.61 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 17.2 mt-10 -55.39 -54.5 42.91 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.975 0.731 . . . . 1.3 112.975 -168.331 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.731 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -42.48 -41.31 2.9 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.739 1.014 . . . . 1.54 113.739 -172.862 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.731 ' H ' HD12 ' A' ' 59' ' ' LEU . 36.4 mtm180 -59.41 -59.45 5.42 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 111.939 0.348 . . . . 2.58 111.939 -176.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.61 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -91.77 -5.67 53.14 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.052 0.76 . . . . 5.32 113.052 -175.352 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 24.6 ptt180 -66.42 -15.09 63.05 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 122.246 -0.284 . . . . 4.48 111.539 -175.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 63' ' ' ARG . 37.7 mtm105 -67.87 -15.95 63.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.243 -0.435 . . . . 4.72 111.438 179.336 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.744 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.38 -35.06 13.91 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.585 0.217 . . . . 1.17 111.585 175.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.653 ' HE1' HD11 ' B' 1008 ' ' LEU . 9.6 m-30 -43.32 -50.53 6.63 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.141 1.163 . . . . 2.81 114.141 -168.064 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.6 m -72.79 -20.53 61.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.101 0.477 . . . . 2.19 111.41 -171.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -90.41 -23.98 20.89 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.785 -0.643 . . . . 2.72 110.297 178.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.744 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 70.1 mt -77.65 -16.06 58.78 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 113.012 0.745 . . . . 1.56 113.012 -173.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.572 HG22 HG13 ' A' ' 74' ' ' ILE . 3.5 p -56.15 -28.9 59.78 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.27 0.47 . . . . 0.7 112.27 -172.526 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.2 t -67.37 -36.62 81.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.39 0.614 . . . . 1.34 109.823 175.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.453 ' OE1' HD22 ' A' ' 68' ' ' LEU . 71.6 mt-30 -72.43 -41.59 66.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.321 -0.854 . . . . 1.42 109.765 177.755 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.433 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.5 mm? -65.71 -32.2 73.61 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.05 -0.523 . . . . 1.37 110.921 176.905 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.423 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 38.6 m80 63.9 40.44 7.41 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.887 -0.783 . . . . 2.72 108.887 -173.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.576 HG21 ' HB3' ' A' ' 113' ' ' GLU . 35.9 mm -49.62 113.74 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-N 114.447 -1.251 . . . . 0.91 111.441 -178.198 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.775 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.81 -170.37 0.24 Allowed Pre-proline 0 CA--C 1.548 0.887 0 N-CA-C 107.922 -1.14 . . . . 0.51 107.922 -168.633 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.775 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.3 Cg_exo -28.71 166.88 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.089 1 C-N-CA 125.407 4.072 . . . . 0.47 115.537 162.857 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.87 -29.18 0.01 OUTLIER Glycine 0 N--CA 1.472 1.053 0 N-CA-C 117.261 1.664 . . . . 0.4 117.261 -173.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 81' ' ' GLN . 32.9 p -68.51 3.36 1.84 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 117.93 0.865 . . . . 0.56 111.997 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.64 -13.39 61.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.339 0.59 . . . . 0.34 109.564 170.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.435 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 50.2 t80 -75.45 -18.43 59.88 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 115.703 -0.68 . . . . 4.13 109.234 173.289 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.525 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 74.2 mt-30 -80.42 -26.99 38.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 122.199 1.0 . . . . 1.03 109.416 172.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m -78.09 -33.05 50.93 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.188 -1.369 . . . . 0.48 110.039 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.675 ' HB2' ' HG ' ' A' ' 110' ' ' LEU . 67.7 t80 -80.42 -17.07 52.89 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.583 0.706 . . . . 1.18 109.378 172.267 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.582 ' HA ' HG12 ' A' ' 87' ' ' VAL . 35.3 tt0 -68.2 -57.99 5.14 Favored 'General case' 0 CA--C 1.498 -1.054 0 CA-C-N 115.109 -0.95 . . . . 0.8 111.178 -174.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.573 ' HG3' ' N ' ' A' ' 86' ' ' VAL . 1.4 pt20 -43.95 -38.88 3.69 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 113.557 -1.656 . . . . 1.62 110.932 178.236 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.587 HG21 ' CE2' ' A' ' 106' ' ' PHE . 1.5 t -78.28 -53.94 13.11 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.734 0 CA-C-N 112.465 -2.152 . . . . 1.3 111.142 -177.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.582 HG12 ' HA ' ' A' ' 84' ' ' GLU . 8.6 p -60.73 -21.61 24.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 122.057 0.932 . . . . 0.85 109.445 -178.031 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.455 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 2.7 m-80 -70.96 -43.77 67.42 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 113.897 -1.501 . . . . 0.91 111.34 173.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.629 ' OE1' ' HA ' ' B' 1009 ' ' ALA . 2.0 pp20? -73.01 -37.56 66.92 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 121.767 0.794 . . . . 2.87 109.055 177.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.911 HD12 HH11 ' A' ' 99' ' ' ARG . 3.5 tp -66.74 -19.82 65.83 Favored 'General case' 0 N--CA 1.433 -1.31 0 CA-C-N 113.731 -1.577 . . . . 1.28 112.015 -165.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.652 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 2.6 p90 -110.64 -28.82 8.29 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 120.524 -0.471 . . . . 2.3 112.0 -173.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.549 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 9.9 ptm180 -72.94 -39.31 66.33 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.289 0.566 . . . . 5.06 111.534 -171.218 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -88.93 13.44 12.76 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.269 -0.878 . . . . 3.12 113.361 -169.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.593 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 128.46 70.66 0.14 Allowed Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 116.952 -2.547 . . . . 2.31 115.459 178.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.652 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 75.0 t -72.06 104.48 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 118.417 1.109 . . . . 1.06 111.066 178.606 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ASN . . . . . 0.553 ' HA ' HD22 ' A' ' 145' ' ' ASN . 1.4 m-20 -111.24 -170.22 1.6 Allowed 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.224 -1.353 . . . . 2.12 108.712 177.793 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 10.8 m-90 -56.1 -46.35 79.11 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 123.515 0.509 . . . . 3.34 111.192 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.758 ' HA3' HG21 ' B' 1015 ' ' ILE . . . -79.05 -30.62 46.13 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.957 -0.64 . . . . 0.69 113.938 -175.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.911 HH11 HD12 ' A' ' 90' ' ' LEU . 16.6 mmt180 -55.61 -42.44 74.89 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 117.216 0.508 . . . . 4.24 111.553 -178.03 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.574 HG22 ' CE2' ' A' ' 104' ' ' PHE . 55.0 mt -67.8 -38.57 80.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.969 -0.56 . . . . 0.44 110.678 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 52.0 t -53.97 -54.18 22.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.937 -0.574 . . . . 1.35 110.033 172.183 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.4 ' O ' ' HB3' ' A' ' 105' ' ' SER . . . -55.68 -40.62 72.56 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.503 -0.772 . . . . 0.44 111.227 177.263 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.4 ' CD1' HG23 ' A' ' 87' ' ' VAL . 6.7 t80 -58.9 -40.96 86.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.372 -0.831 . . . . 1.49 111.069 177.472 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.574 ' CE2' HG22 ' A' ' 100' ' ' ILE . 39.1 m-85 -71.11 -34.09 70.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.694 0.283 . . . . 3.29 110.506 175.494 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.607 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 25.3 t -58.95 -57.49 12.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.078 -0.51 . . . . 1.19 111.127 178.165 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.587 ' CE2' HG21 ' A' ' 86' ' ' VAL . 34.6 t80 -68.11 -31.89 71.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 2.89 110.231 -178.452 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.483 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -67.3 -46.21 73.09 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.786 -0.721 . . . . 0.3 111.785 177.208 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.908 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.56 -31.98 81.84 Favored Glycine 0 N--CA 1.441 -0.982 0 C-N-CA 120.646 -0.787 . . . . 0.23 111.148 176.37 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.45 -30.56 67.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.577 -0.311 . . . . 0.31 110.526 175.511 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.675 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -65.02 -42.54 94.3 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 107.974 -1.121 . . . . 1.12 107.974 178.795 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.735 ' SG ' HG22 ' A' ' 123' ' ' VAL . 38.2 t -52.74 -54.8 28.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.101 -1.409 . . . . 0.26 110.479 172.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.5 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 73.8 t -62.97 -42.78 97.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.202 -0.453 . . . . 0.35 111.864 -177.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.576 ' HB3' HG21 ' A' ' 74' ' ' ILE . 3.4 mm-40 -59.08 -29.13 67.11 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.606 -0.438 . . . . 2.51 110.991 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.401 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 47.7 m -73.31 -39.23 65.45 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.963 -0.754 . . . . 0.28 108.963 176.331 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.639 ' HA ' ' HG3' ' A' ' 120' ' ' GLN . 80.5 t -67.07 -38.13 80.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.213 -0.903 . . . . 1.23 109.397 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -52.75 -50.44 63.48 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 113.364 -1.744 . . . . 0.6 111.338 -179.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 113' ' ' GLU . 20.7 mmtt -88.18 16.18 6.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.137 -0.483 . . . . 1.62 110.394 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 63.87 49.32 2.89 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.82 0.819 . . . . 1.88 110.729 178.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.564 ' HE1' HG22 ' A' ' 74' ' ' ILE . 26.4 mtm -130.67 44.69 2.92 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.627 -1.17 . . . . 0.31 108.203 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.639 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 0.0 OUTLIER -62.45 -6.99 3.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.283 -0.871 . . . . 1.15 112.958 -173.795 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.537 HG23 HD22 ' A' ' 122' ' ' LEU . 26.6 m -66.01 -21.85 29.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 O-C-N 122.14 -0.35 . . . . 0.46 111.577 176.422 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.688 HD13 ' HD3' ' A' ' 125' ' ' ARG . 3.3 mm? -75.53 -25.24 57.02 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 110.291 -0.263 . . . . 0.26 110.291 178.413 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.735 HG22 ' SG ' ' A' ' 111' ' ' CYS . 49.6 t -43.86 -53.63 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 123.917 0.761 . . . . 0.25 112.059 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.579 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 12.6 t -71.99 -37.77 69.8 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.853 -0.339 . . . . 1.35 110.718 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.688 ' HD3' HD13 ' A' ' 122' ' ' LEU . 63.7 mtp180 -61.0 -56.52 20.11 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.305 -0.407 . . . . 2.67 110.512 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.59 HG22 ' SD ' ' A' ' 130' ' ' MET . 70.7 mt -52.25 -50.67 36.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.807 -0.633 . . . . 0.23 110.305 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.8 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -57.18 -36.17 70.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.851 0.358 . . . . 0.29 111.378 179.036 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.969 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -63.54 -57.69 9.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.311 0.577 . . . . 0.28 110.556 176.137 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -66.72 -26.9 67.23 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.719 -1.128 . . . . 3.91 111.197 -174.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.59 ' SD ' HG22 ' A' ' 126' ' ' ILE . 89.7 mtp -69.23 -53.99 17.05 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.081 0.467 . . . . 1.08 110.972 175.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.511 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -59.33 -39.26 82.59 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.8 -0.636 . . . . 0.25 111.073 -178.259 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 86.7 m -63.56 -47.32 82.04 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.763 -0.375 . . . . 0.4 111.022 176.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.589 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 12.1 t80 -55.43 -39.35 70.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.178 0.514 . . . . 3.13 109.847 178.675 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.883 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.3 OUTLIER -59.91 -60.71 3.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.821 -0.627 . . . . 0.95 109.855 170.833 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -45.94 -44.36 14.72 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.054 -0.975 . . . . 0.46 113.245 -179.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -86.14 -51.87 6.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.989 0.423 . . . . 0.59 112.047 -178.313 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' HIS . . . . . 0.589 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 8.7 m80 -89.54 -49.7 6.52 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.889 0.7 . . . . 1.45 112.889 -168.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.883 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -76.71 -44.82 31.94 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 113.0 0.741 . . . . 1.2 113.0 -169.906 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.618 ' HA ' HD12 ' A' ' 142' ' ' ILE . 17.6 tt0 -42.23 -53.57 8.6 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.106 -0.952 . . . . 0.75 113.254 -171.576 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.545 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 24.3 Cg_exo -63.11 -42.55 22.76 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 121.76 1.64 . . . . 0.56 111.634 178.65 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' TRP . . . . . 0.507 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -56.8 -48.71 77.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.283 -0.871 . . . . 1.2 110.421 177.514 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.618 HD12 ' HA ' ' A' ' 139' ' ' GLU . 42.6 mt -49.76 -49.71 19.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.266 -0.879 . . . . 0.32 111.455 175.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.5 mm-40 -58.86 -32.64 69.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.543 -0.753 . . . . 0.57 111.355 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.1 mm-40 -66.42 -19.45 65.8 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.304 0.574 . . . . 0.78 111.1 176.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' ASN . . . . . 0.553 HD22 ' HA ' ' A' ' 96' ' ' ASN . 2.2 m120 -108.0 3.25 23.86 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.469 -0.787 . . . . 0.93 109.522 -175.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.32 -49.17 0.89 Allowed Glycine 0 N--CA 1.44 -1.081 0 CA-C-N 115.156 -0.929 . . . . 0.56 112.764 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' GLY . . . . . 0.447 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 139.66 178.95 17.19 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.765 -0.731 . . . . 0.49 111.757 -177.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.611 ' HZ2' ' HG3' ' A' ' 139' ' ' GLU . 19.0 m-90 -68.41 -42.53 78.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.694 0.283 . . . . 3.57 110.614 -178.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 3.5 m-20 -57.75 -33.91 68.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 1.96 110.369 176.582 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.539 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 50.2 m -59.71 -40.77 89.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.116 -0.493 . . . . 0.67 111.488 178.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.56 ' CD2' ' HA ' ' A' ' 148' ' ' TRP . 19.5 m-85 -59.75 -36.16 76.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.248 0.547 . . . . 3.0 109.756 -178.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.761 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.4 m -81.28 -24.54 10.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.652 -0.703 . . . . 1.15 110.17 178.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 11.2 mm-40 -59.19 -26.68 65.01 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.123 0.487 . . . . 1.67 109.964 171.044 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 150' ' ' THR . 1.4 mt -97.53 -55.22 2.89 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.718 -0.673 . . . . 1.3 110.737 179.62 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 56.3 m-85 -112.47 16.98 19.65 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.059 -0.518 . . . . 4.24 111.749 -170.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.659 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -63.8 159.77 38.74 Favored Glycine 0 CA--C 1.497 -1.071 0 CA-C-O 122.605 1.114 . . . . 1.1 115.164 -168.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.773 ' HB3' ' HB3' ' A' ' 48' ' ' GLN . 46.5 t-20 -114.03 146.03 40.75 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 112.599 -1.8 . . . . 1.29 109.68 -174.343 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.571 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 1.6 p-10 -95.5 16.34 17.31 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.986 -0.286 . . . . 2.99 111.239 -176.863 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -50.15 -42.49 50.95 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.15 -0.477 . . . . 2.52 111.938 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -77.09 -35.66 56.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.689 0.28 . . . . 2.87 110.432 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -54.95 -58.24 8.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.896 -0.593 . . . . 3.2 111.326 177.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 4.2 pt-20 -64.73 -33.52 76.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.956 -0.566 . . . . 3.72 111.411 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 33.3 t -63.5 -45.73 89.33 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.034 0.445 . . . . 4.18 109.955 178.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -75.07 -16.92 60.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.212 0.53 . . . . 5.82 110.801 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -77.86 -19.79 54.21 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.309 -0.859 . . . . 4.77 110.589 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -52.58 -49.48 52.52 Favored Glycine 0 C--N 1.331 0.268 0 CA-C-N 115.961 -0.563 . . . . 5.1 113.624 -174.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -75.21 -23.98 57.69 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.088 0.47 . . . . 5.72 111.293 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -84.3 3.25 36.44 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.163 0.506 . . . . 5.88 110.199 -179.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.65 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 3.0 tmt_? -82.57 -17.84 43.44 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.527 -0.916 . . . . 7.34 108.527 175.791 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -86.18 7.44 25.01 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.312 -0.858 . . . . 6.97 110.48 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 66.82 -176.97 0.2 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.59 -0.732 . . . . 6.97 111.548 177.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 -137.04 137.51 39.44 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.103 -0.499 . . . . 9.35 110.132 177.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -114.36 131.35 56.58 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.75 -0.463 . . . . 11.4 109.75 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -86.94 94.84 9.71 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.964 0.411 . . . . 11.52 110.103 -179.13 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 71.5 t60 -109.94 -39.32 5.1 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.035 -0.529 . . . . 14.48 109.933 177.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -143.76 114.03 7.41 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.092 -0.503 . . . . 15.37 110.109 -178.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -90.39 129.98 36.52 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.751 -0.462 . . . . 16.02 109.751 177.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.454 ' H ' HD23 ' A' ' 178' ' ' LEU . 1.8 pt? -132.48 135.12 45.82 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.743 -0.466 . . . . 17.99 109.743 178.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -120.11 -45.01 2.47 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.033 0.444 . . . . 19.19 110.148 -178.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 15.8 m-70 -82.25 122.28 27.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.989 -0.55 . . . . 22.26 110.147 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -69.31 -26.51 64.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.942 0.401 . . . . 22.51 110.439 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 29.6 m-70 -74.28 105.54 5.51 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.523 -0.547 . . . . 24.89 109.523 172.387 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 29.2 m80 -91.02 87.77 6.73 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.187 -0.461 . . . . 25.58 110.134 -174.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 74.15 -9.59 1.25 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.673 -0.694 . . . . 27.37 111.509 177.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 11.2 p80 . . . . . 0 C--O 1.245 0.854 0 CA-C-O 118.252 -0.88 . . . . 29.06 110.076 176.254 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B 1001 ' ' ACE . . . . . 0.507 ' O ' ' HD3' ' B' 1006 ' ' ARG . . . . . . . . 0 C--O 1.234 0.257 . . . . . . . . 4.05 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -81.33 -28.88 42.54 Favored Glycine 0 N--CA 1.451 -0.349 0 O-C-N 121.555 -0.715 . . . . 2.97 112.018 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.654 ' HA ' ' C2 ' ' B' 1100 ' ' 33B . 14.1 m -110.78 -160.79 0.73 Allowed 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 110.189 -0.3 . . . . 1.94 110.189 178.703 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.568 ' HA ' HD22 ' B' 1008 ' ' LEU . 0.8 OUTLIER 39.81 -87.65 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 O-C-N 124.708 1.255 . . . . 1.63 113.536 175.41 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . -29.82 -44.05 0.06 OUTLIER Glycine 0 CA--C 1.532 1.124 0 CA-C-N 117.844 0.293 . . . . 1.2 113.829 161.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1006 ' ' ARG . . . . . 0.507 ' HD3' ' O ' ' B' 1001 ' ' ACE . 3.4 mpt_? -98.43 -13.59 20.51 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 113.027 0.751 . . . . 2.88 113.027 177.217 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -97.13 -53.09 3.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.306 0.484 . . . . 1.31 112.306 -170.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.653 HD11 ' HE1' ' A' ' 65' ' ' PHE . 2.7 mm? -64.38 -46.93 81.24 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.832 -0.803 . . . . 1.33 108.832 178.386 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B 1009 ' ' ALA . . . . . 0.629 ' HA ' ' OE1' ' A' ' 89' ' ' GLU . . . -38.96 -51.8 1.79 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.326 -1.306 . . . . 0.88 111.739 167.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.834 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -77.67 -55.6 5.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.536 -1.211 . . . . 1.03 111.975 -173.285 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.661 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 53.0 m-85 -66.02 -21.74 66.41 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.157 -0.474 . . . . 1.67 110.692 -178.309 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B 1012 ' ' GLY . . . . . 0.485 ' HA2' ' CE1' ' A' ' 57' ' ' PHE . . . -80.27 -5.61 89.64 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.836 -0.62 . . . . 0.78 112.796 -179.661 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.8 t70 -82.65 -8.78 59.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.323 0.583 . . . . 1.9 109.892 174.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 3.2 m -100.01 87.36 3.47 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.488 -0.93 . . . . 1.44 108.488 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.758 HG21 ' HA3' ' A' ' 98' ' ' GLY . 18.0 mt -102.87 -78.45 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 116.283 -0.417 . . . . 2.91 111.077 -171.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 44.4 t30 -131.11 91.0 2.97 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.079 -0.51 . . . . 4.29 110.628 -175.22 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -122.21 -74.06 0.63 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.997 -0.547 . . . . 8.17 110.313 178.087 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.648 -0.251 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.834 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.516 ' HE3' ' HB3' ' A' ' 135' ' ' ASN . 86.1 mtp . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 120.832 0.349 . . . . 6.21 110.092 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.4 m -95.47 157.27 15.97 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.647 -0.501 . . . . 1.87 109.647 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.422 ' O ' ' HB2' ' A' ' 37' ' ' ALA . 27.8 mp0 -100.08 -7.85 24.45 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.884 0.373 . . . . 2.42 110.153 179.31 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.445 ' O ' HD13 ' A' ' 8' ' ' LEU . 1.7 p -60.27 -23.29 64.01 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.838 -0.619 . . . . 1.25 112.03 -179.071 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.576 ' HA ' HD22 ' A' ' 8' ' ' LEU . 3.9 p30 -67.58 -22.32 65.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.931 -0.577 . . . . 1.78 111.115 176.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.843 HH12 ' HA ' ' A' ' 128' ' ' ALA . 23.9 tpp180 -58.23 -50.69 72.67 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.235 0.541 . . . . 1.4 109.864 175.321 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.716 ' OE1' ' HA2' ' A' ' 40' ' ' GLY . 33.6 mt-10 -50.62 -55.71 15.13 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.324 -1.307 . . . . 0.68 110.808 -179.084 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.576 HD22 ' HA ' ' A' ' 5' ' ' ASN . 2.8 mp -43.61 -45.97 7.01 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.151 -0.931 . . . . 1.16 111.345 176.694 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.5 t -70.2 -60.74 2.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.121 0.486 . . . . 0.27 110.662 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 6' ' ' ARG . 63.7 t -53.57 -53.46 25.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.482 -0.781 . . . . 0.33 112.477 -175.275 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -54.25 -35.37 62.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.483 -0.78 . . . . 0.59 111.126 -175.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.57 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 15.2 t80 -88.34 -37.33 16.03 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 120.478 -0.489 . . . . 1.61 112.14 -175.538 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 1.013 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 2.8 mp -60.43 -36.93 79.34 Favored 'General case' 0 CA--C 1.521 -0.152 0 C-N-CA 119.386 -0.926 . . . . 0.34 109.301 176.277 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.528 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 35.7 t -63.35 -37.37 87.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.642 -0.708 . . . . 1.05 110.354 175.255 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -71.41 -26.09 62.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.666 -0.697 . . . . 1.22 110.48 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.57 ' HG2' ' O ' ' A' ' 12' ' ' PHE . 12.8 mmmt -75.86 -43.15 47.06 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 112.133 0.42 . . . . 1.41 112.133 -179.227 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.58 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -59.53 -19.08 45.74 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.672 0.272 . . . . 1.35 111.327 177.139 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.1 t -60.37 -44.32 95.71 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.322 0.489 . . . . 0.94 112.322 -176.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -66.97 -10.54 50.51 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.631 0.729 . . . . 1.37 111.673 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.417 ' HD3' HG11 ' A' ' 112' ' ' VAL . 19.8 mmmt -105.85 -30.2 9.53 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 122.079 0.942 . . . . 2.2 108.936 -177.286 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.17 19.34 21.6 Favored Glycine 0 N--CA 1.442 -0.948 0 CA-C-N 114.297 -1.32 . . . . 0.53 111.622 175.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -102.38 162.88 12.57 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.771 0.319 . . . . 0.76 110.852 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.2 t -98.11 149.86 22.06 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 115.961 -0.563 . . . . 0.52 110.397 178.492 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.596 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 52.4 t-105 -77.84 -52.72 8.44 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.225 -0.898 . . . . 3.36 109.968 174.446 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.7 m -68.49 -22.16 64.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.823 -0.626 . . . . 1.37 112.248 -172.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -67.2 -27.69 67.47 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.745 -0.382 . . . . 1.11 111.73 178.565 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -115.58 -8.48 12.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.215 -0.448 . . . . 1.28 111.894 -174.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.639 ' HB3' HG22 ' A' ' 30' ' ' VAL . 49.5 m -101.66 154.34 18.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.715 0.769 . . . . 1.81 113.066 -174.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.534 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.8 t70 -115.58 -14.8 11.48 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 113.879 -1.509 . . . . 2.31 109.828 -179.512 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.856 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.0 m -48.48 -73.01 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.463 -1.244 . . . . 0.92 113.092 -167.74 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.856 ' H ' HG23 ' A' ' 30' ' ' VAL . 44.2 mt-10 -92.14 0.89 57.47 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.561 -0.533 . . . . 2.74 109.561 176.52 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.534 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.9 tt0 -64.18 -51.14 65.24 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.547 -0.751 . . . . 1.45 110.482 -178.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -101.07 -75.89 0.58 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.95 -0.568 . . . . 1.87 111.043 -176.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -79.82 161.43 25.66 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.506 -0.316 . . . . 3.39 110.19 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.1 p -129.96 98.33 4.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.511 0.672 . . . . 2.25 110.978 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.967 ' HG3' ' H ' ' A' ' 37' ' ' ALA . 6.2 pt-20 -95.64 -83.37 0.37 Allowed 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.095 -0.957 . . . . 3.34 111.103 -179.209 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.967 ' H ' ' HG3' ' A' ' 36' ' ' GLU . . . -62.82 137.85 96.88 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 114.697 -1.138 . . . . 1.92 111.941 178.103 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.776 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 38.5 Cg_exo -62.12 174.26 2.66 Favored 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 123.172 2.582 . . . . 1.87 111.691 173.279 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -74.19 -7.5 52.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.122 0.487 . . . . 4.64 110.609 179.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.716 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 160.07 69.16 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.651 -0.704 . . . . 2.15 111.55 179.166 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.833 HG23 ' H ' ' A' ' 42' ' ' GLU . 2.2 t -72.75 -75.55 0.14 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 120.456 -0.498 . . . . 1.12 111.022 -173.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.833 ' H ' HG23 ' A' ' 41' ' ' THR . 13.9 pt-20 -92.91 -30.99 15.11 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 122.374 1.083 . . . . 2.02 109.454 174.4 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.805 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 66.3 m -69.84 -16.63 63.29 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 113.218 -1.81 . . . . 1.25 114.323 -167.159 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -42.81 -41.85 3.39 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 118.254 0.479 . . . . 1.91 111.831 -178.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.44 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -83.65 -42.29 16.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.075 0.464 . . . . 0.52 110.47 174.26 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.701 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 75.9 t -46.95 -66.91 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 C-N-CA 124.05 0.94 . . . . 1.41 111.857 175.289 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.805 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.7 ptpt -61.27 -38.1 85.52 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.742 -0.663 . . . . 0.67 110.462 -177.244 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.581 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 6.6 mm-40 -59.61 -27.23 66.12 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 116.233 -0.44 . . . . 0.99 110.958 175.365 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.812 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -83.84 -45.75 12.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.235 0.541 . . . . 0.42 110.413 172.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.686 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -49.05 -42.25 37.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.826 -1.079 . . . . 1.33 112.003 -179.697 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.631 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 8.4 ptp180 -76.88 -28.45 55.4 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.336 0.589 . . . . 2.17 110.017 -170.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.438 ' HG2' ' HG3' ' A' ' 51' ' ' ARG . 19.1 mm-40 -77.85 -44.18 28.05 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.911 -1.041 . . . . 1.1 110.182 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.21 -43.46 98.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.665 -0.698 . . . . 0.53 109.695 174.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.699 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.87 -41.46 99.87 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-N 115.556 -0.747 . . . . 0.7 111.48 175.054 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -52.56 -39.3 61.32 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 122.786 0.434 . . . . 1.04 111.123 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.419 ' HA ' HD11 ' A' ' 59' ' ' LEU . 50.7 mt-10 -80.05 -27.19 39.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.12 -0.491 . . . . 2.29 111.498 178.303 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.908 ' HZ ' ' HA2' ' B' 1012 ' ' GLY . 1.4 t80 -80.84 -27.46 36.46 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.537 -0.301 . . . . 2.29 111.235 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.798 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 47.7 mt-10 -56.26 -65.48 0.6 Allowed 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 111.932 0.345 . . . . 1.3 111.932 -176.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.79 ' H ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -52.05 -35.44 47.31 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.323 0.39 . . . . 1.54 111.337 -178.616 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.704 ' N ' HD22 ' A' ' 59' ' ' LEU . 46.0 mtt180 -52.83 -55.18 24.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.58 -0.736 . . . . 2.58 111.756 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.798 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 29.3 p90 -90.78 -19.68 23.21 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.682 -0.407 . . . . 5.32 111.757 -177.436 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -58.81 -30.11 67.39 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 122.681 0.392 . . . . 4.48 111.55 -174.744 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -62.64 -37.16 85.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 4.72 110.685 178.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.464 ' HB1' HD13 ' A' ' 68' ' ' LEU . . . -90.41 -31.23 16.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.426 . . . . 1.17 110.807 178.115 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.585 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 56.9 t80 -42.55 -48.47 5.34 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.821 0.848 . . . . 2.81 113.199 -174.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.5 t -62.75 -38.14 89.37 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.861 0.362 . . . . 2.19 110.945 -174.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -87.57 -28.14 22.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.0 0.429 . . . . 2.72 110.762 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.503 ' HA ' ' OE1' ' A' ' 71' ' ' GLN . 0.5 OUTLIER -60.13 -22.5 62.91 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 113.099 0.777 . . . . 1.56 113.099 -175.349 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.456 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 4.8 p -52.99 -26.99 17.09 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 117.999 0.363 . . . . 0.7 111.391 -179.549 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.7 t -58.98 -58.25 9.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.377 0.608 . . . . 1.34 110.055 173.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.503 ' OE1' ' HA ' ' A' ' 68' ' ' LEU . 21.4 mp0 -51.35 -45.59 62.41 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 124.397 1.079 . . . . 1.42 111.161 174.477 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.49 ' HB3' ' CD1' ' A' ' 74' ' ' ILE . 2.4 mm? -66.62 -31.86 72.82 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 116.056 -0.52 . . . . 1.37 111.834 179.082 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.9 m80 57.1 42.64 25.49 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.65 -0.87 . . . . 2.72 108.65 -174.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.508 HG22 ' HE1' ' A' ' 119' ' ' MET . 31.9 mm -49.67 115.66 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 113.582 -1.644 . . . . 0.91 113.141 -173.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.772 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -157.04 -171.61 0.29 Allowed Pre-proline 0 CA--C 1.551 0.988 0 CA-C-N 114.272 -1.331 . . . . 0.51 107.798 -171.796 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.772 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 41.0 Cg_exo -28.63 166.67 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.335 1 C-N-CA 125.453 4.102 . . . . 0.47 115.976 164.895 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.416 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -31.5 -27.17 0.01 OUTLIER Glycine 0 N--CA 1.474 1.203 0 N-CA-C 117.441 1.737 . . . . 0.4 117.441 -173.078 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.432 ' N ' ' O ' ' A' ' 76' ' ' PRO . 24.1 p -69.39 4.34 1.81 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 117.888 0.844 . . . . 0.56 112.007 -179.446 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.19 -14.58 63.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 121.393 0.616 . . . . 0.34 109.742 172.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -76.6 -14.73 59.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.687 -0.688 . . . . 4.13 109.92 176.032 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.496 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 37.3 mt-30 -86.99 -24.11 24.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.623 0.725 . . . . 1.03 109.978 173.539 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.0 m -71.22 -51.19 26.08 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.711 -1.131 . . . . 0.48 109.249 170.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -68.2 -15.94 63.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.82 -1.082 . . . . 1.18 110.202 174.123 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.629 ' HA ' HG12 ' A' ' 87' ' ' VAL . 41.5 tt0 -64.22 -50.55 67.6 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.172 0.51 . . . . 0.8 110.257 176.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.49 ' OE1' HG21 ' B' 1004 ' ' VAL . 53.4 mt-30 -44.43 -43.63 7.87 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 114.414 -1.266 . . . . 1.62 111.302 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.676 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.6 p -91.45 -36.77 8.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 CA-C-N 113.546 -1.661 . . . . 1.3 112.039 -171.821 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.629 HG12 ' HA ' ' A' ' 84' ' ' GLU . 6.9 p -66.38 -21.31 28.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 121.845 0.831 . . . . 0.85 109.277 175.333 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.609 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.5 m-80 -72.74 -51.47 19.04 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.193 -1.367 . . . . 0.91 111.137 175.813 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 1.024 ' HG2' ' HA2' ' B' 1005 ' ' GLY . 0.0 OUTLIER -64.96 -40.04 94.39 Favored 'General case' 0 CA--C 1.496 -1.109 0 N-CA-C 108.77 -0.826 . . . . 2.87 108.77 -178.622 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.618 ' HG ' ' OE1' ' A' ' 89' ' ' GLU . 15.5 mt -57.21 -27.08 61.68 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-N 113.851 -1.522 . . . . 1.28 110.8 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.621 ' HA ' HG22 ' A' ' 95' ' ' VAL . 76.4 t80 -97.4 -49.05 5.06 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.341 0.591 . . . . 2.3 110.727 -171.569 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.609 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER -75.56 -32.77 60.52 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.595 -0.73 . . . . 5.06 110.885 -173.095 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.518 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 1.4 m-20 -94.55 20.17 8.81 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.676 -0.693 . . . . 3.12 112.549 -174.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.69 70.97 0.11 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 117.182 -2.437 . . . . 2.31 116.116 177.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 1.042 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 46.6 t -75.88 98.86 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 118.927 1.363 . . . . 1.06 111.271 171.714 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -113.35 -170.94 1.78 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.953 -1.021 . . . . 2.12 109.601 177.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.685 ' HA ' ' CE2' ' A' ' 151' ' ' PHE . 13.6 m-90 -61.79 -46.7 88.42 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.112 -0.495 . . . . 3.34 110.643 178.297 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.453 ' HA3' HG12 ' B' 1015 ' ' ILE . . . -78.54 -20.37 71.73 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.89 -0.595 . . . . 0.69 113.9 -174.682 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 1.042 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -68.91 -30.57 69.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 117.336 0.568 . . . . 4.24 110.0 -176.335 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 85.4 mt -76.76 -32.36 20.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.329 -0.396 . . . . 0.44 110.642 -178.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.429 ' HA ' ' CD1' ' A' ' 104' ' ' PHE . 0.8 OUTLIER -63.84 -26.48 40.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-O 121.321 0.581 . . . . 1.35 109.51 172.038 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -73.77 -49.24 26.37 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.396 -0.594 . . . . 0.44 109.396 173.221 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.665 ' HB2' ' NH1' ' A' ' 99' ' ' ARG . 32.7 t80 -49.93 -55.42 14.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.731 -1.122 . . . . 1.49 111.697 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.517 ' HA ' ' CE ' ' A' ' 130' ' ' MET . 0.2 OUTLIER -72.54 -18.46 61.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.974 0.416 . . . . 3.29 110.733 -174.278 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.561 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 23.0 t -81.75 -44.32 17.18 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.219 -0.446 . . . . 1.19 110.524 177.475 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.566 ' CZ ' HD12 ' B' 1008 ' ' LEU . 19.9 m-30 -65.41 -39.92 92.74 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 116.441 -0.345 . . . . 2.89 110.107 178.556 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLY . . . . . 0.839 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -64.49 -37.25 94.19 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.821 -0.704 . . . . 0.3 111.673 176.695 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 1.013 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.9 -34.56 87.5 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 120.539 -0.839 . . . . 0.23 111.407 175.168 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.585 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -72.23 -34.1 68.06 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.8 0.333 . . . . 0.31 110.463 176.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.565 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -60.65 -40.14 90.93 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 122.21 1.005 . . . . 1.12 108.514 179.564 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.692 ' HB2' HD23 ' A' ' 13' ' ' LEU . 33.3 t -52.74 -53.92 41.11 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 113.74 -1.573 . . . . 0.26 110.344 173.322 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.417 HG11 ' HD3' ' A' ' 20' ' ' LYS . 54.4 t -61.21 -42.32 92.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.031 -0.531 . . . . 0.35 111.54 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.487 ' HB3' HG21 ' A' ' 74' ' ' ILE . 32.1 mt-10 -55.41 -34.11 64.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.053 0.454 . . . . 2.51 110.797 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.447 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 30.3 m -74.14 -38.09 63.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.466 0.65 . . . . 0.28 109.268 178.659 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.644 ' HA ' ' HG3' ' A' ' 120' ' ' GLN . 85.9 t -67.51 -34.29 67.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 115.127 -0.942 . . . . 1.23 109.538 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.48 -50.31 60.1 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.594 -1.639 . . . . 0.6 111.381 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 10.6 mmtp -89.74 11.9 18.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.03 -0.532 . . . . 1.62 110.541 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 61.8 56.29 2.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.93 0.871 . . . . 1.88 110.588 -176.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.508 ' HE1' HG22 ' A' ' 74' ' ' ILE . 32.7 mtm -129.44 43.68 3.1 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.388 -1.278 . . . . 0.31 107.61 178.034 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.644 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 14.1 mp0 -61.35 -7.14 2.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.877 -1.056 . . . . 1.15 113.199 -172.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.597 HG23 HD22 ' A' ' 122' ' ' LEU . 17.9 m -62.94 -28.53 45.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 O-C-N 121.916 -0.49 . . . . 0.46 111.187 173.285 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.755 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.4 mm? -69.36 -28.08 65.89 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 110.267 -0.271 . . . . 0.26 110.267 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.691 HG22 ' SG ' ' A' ' 111' ' ' CYS . 54.7 t -43.04 -53.91 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 O-C-N 123.955 0.784 . . . . 0.25 112.124 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.604 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 3.3 t -75.1 -34.89 61.78 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.877 0.37 . . . . 1.35 110.662 -178.484 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.755 ' HD2' HD13 ' A' ' 122' ' ' LEU . 93.0 mtt180 -64.22 -50.28 68.63 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.081 -0.509 . . . . 2.67 110.803 -177.043 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.565 HD13 ' HB3' ' A' ' 110' ' ' LEU . 75.8 mt -55.12 -50.03 67.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.675 -0.693 . . . . 0.23 110.614 179.361 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.596 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -56.7 -34.2 67.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.408 -0.36 . . . . 0.29 111.639 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.843 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -59.41 -61.93 2.26 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.36 0.6 . . . . 0.28 110.448 175.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -62.17 -31.87 72.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.853 -1.067 . . . . 3.91 111.258 -177.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.839 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 7.5 mmm -61.91 -59.83 4.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.212 -0.449 . . . . 1.08 111.683 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -64.01 -36.32 83.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.429 -0.35 . . . . 0.25 110.78 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.453 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 52.1 m -66.9 -39.21 87.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.416 -0.356 . . . . 0.4 111.127 177.323 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.547 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 55.4 t80 -60.31 -43.16 96.6 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.801 -0.444 . . . . 3.13 109.801 175.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.54 HD13 ' HB2' ' A' ' 5' ' ' ASN . 5.7 tt -60.34 -50.27 74.29 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.745 -0.835 . . . . 0.95 108.745 174.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' ASN . . . . . 0.516 ' HB3' ' HE3' ' A' ' 1' ' ' MET . 3.8 m-80 -48.98 -58.31 5.1 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.932 -0.576 . . . . 0.46 112.443 178.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -80.23 -45.03 18.7 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 0.59 112.054 -172.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' HIS . . . . . 0.547 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 9.4 m-70 -91.97 -50.55 5.65 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.361 0.874 . . . . 1.45 113.361 -171.155 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.539 HD21 ' NH2' ' A' ' 99' ' ' ARG . 58.8 mt -91.75 -34.96 14.41 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.607 0.966 . . . . 1.2 113.607 -165.319 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.627 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 31.7 tt0 -51.38 -49.84 79.75 Favored Pre-proline 0 C--N 1.324 -0.526 0 O-C-N 123.313 0.383 . . . . 0.75 111.657 -174.468 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 52.8 Cg_exo -52.87 -51.31 11.39 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 121.772 1.648 . . . . 0.56 111.624 175.316 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -54.5 -54.22 43.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.45 -0.795 . . . . 1.2 110.544 178.569 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.575 HD12 ' HA ' ' A' ' 139' ' ' GLU . 13.6 mt -42.84 -51.84 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.406 -0.815 . . . . 0.32 111.961 175.262 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.627 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 14.8 mm-40 -67.07 -30.01 69.94 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.934 -0.576 . . . . 0.57 111.747 -176.323 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.0 mm-40 -68.28 -22.28 64.75 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.498 0.666 . . . . 0.78 110.7 175.24 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -101.72 3.84 40.03 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.28 -0.873 . . . . 0.93 108.974 -174.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 125.48 -34.02 3.45 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.696 -1.138 . . . . 0.56 113.135 173.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 111.7 162.92 17.18 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 111.1 -0.8 . . . . 0.49 111.1 -174.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.659 ' HB3' HG22 ' A' ' 46' ' ' VAL . 39.9 m95 -58.21 -33.59 69.48 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.124 0.787 . . . . 3.57 113.124 -172.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.515 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 29.8 m-20 -56.56 -42.87 79.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.852 0.358 . . . . 1.96 110.082 176.068 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 150' ' ' THR . . . . . 0.524 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 25.1 m -60.59 -36.48 78.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.733 -0.667 . . . . 0.67 111.721 179.064 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 151' ' ' PHE . . . . . 0.685 ' CE2' ' HA ' ' A' ' 97' ' ' TRP . 2.2 m-85 -62.81 -39.68 95.04 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.184 0.516 . . . . 3.0 109.641 -177.714 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.621 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.4 m -75.5 -24.44 17.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.859 -0.61 . . . . 1.15 110.053 176.114 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 12.8 mm-40 -60.88 -23.46 65.2 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 121.672 -0.642 . . . . 1.67 110.478 173.75 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.6 mt -96.23 -56.04 2.76 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.886 -0.597 . . . . 1.3 110.101 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 155' ' ' TYR . . . . . 0.668 ' OH ' ' HB3' ' A' ' 151' ' ' PHE . 12.0 p90 -121.55 26.51 8.75 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.289 0.566 . . . . 4.24 112.49 -173.161 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.812 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -61.48 161.4 26.68 Favored Glycine 0 C--N 1.305 -1.185 0 CA-C-N 115.165 -0.925 . . . . 1.1 113.442 -178.003 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.581 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 26.0 t-20 -52.65 109.03 0.36 Allowed 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 114.011 -1.094 . . . . 1.29 111.299 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.75 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 0.6 OUTLIER -98.63 -7.1 28.57 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.755 -0.461 . . . . 2.99 109.755 179.243 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -51.6 -35.51 41.82 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.804 -0.635 . . . . 2.52 110.88 176.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -97.66 -35.08 10.69 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.029 -0.532 . . . . 2.87 110.689 173.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.75 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -57.24 -66.43 0.46 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.914 -0.585 . . . . 3.2 112.068 -175.494 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 162' ' ' GLU . . . . . 0.608 ' HA ' ' HB3' ' A' ' 165' ' ' LYS . 6.6 pt-20 -66.65 -23.77 66.2 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 121.069 -0.252 . . . . 3.72 111.266 -179.448 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 22.6 t -65.18 -42.29 93.78 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.607 -0.516 . . . . 4.18 109.607 178.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 164' ' ' ARG . . . . . 0.427 ' O ' ' HG3' ' A' ' 168' ' ' GLU . 29.8 mmt180 -79.42 -33.57 42.49 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-O 121.444 0.64 . . . . 5.82 110.285 176.627 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 165' ' ' LYS . . . . . 0.608 ' HB3' ' HA ' ' A' ' 162' ' ' GLU . 16.4 ttpp -56.24 -44.77 79.95 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.043 -0.981 . . . . 4.77 110.952 177.172 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -63.28 -29.12 73.53 Favored Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.645 -0.788 . . . . 5.1 113.02 -175.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -89.97 -12.91 37.33 Favored 'General case' 0 C--N 1.329 -0.326 0 O-C-N 122.464 -0.433 . . . . 5.72 111.24 178.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 164' ' ' ARG . 44.2 mt-10 -71.33 -17.97 62.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.13 0.49 . . . . 5.88 109.976 172.319 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.525 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 3.6 tmt_? -70.78 -33.44 70.76 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.529 -0.915 . . . . 7.34 108.529 177.206 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -105.77 27.19 8.72 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.346 -0.843 . . . . 6.97 109.993 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -66.07 94.89 0.26 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.5 -0.773 . . . . 6.97 110.066 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -137.51 16.74 2.93 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.476 0.655 . . . . 9.35 109.693 -177.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -135.08 -58.13 0.8 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.442 -0.799 . . . . 11.4 109.511 178.38 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 62.8 22.2 13.25 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.017 -0.992 . . . . 11.52 111.553 178.317 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -80.15 -30.55 38.93 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.326 -0.62 . . . . 14.48 109.326 175.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -69.41 90.23 0.52 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.647 -0.706 . . . . 15.37 109.486 177.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -75.53 100.34 4.52 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.061 -0.518 . . . . 16.02 110.69 -177.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 51.6 tp -78.14 -65.52 0.97 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.124 -0.695 . . . . 17.99 109.124 175.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -177.78 172.02 1.76 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.28 -0.873 . . . . 19.19 108.8 177.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 18.2 p80 -99.73 150.55 22.19 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.401 -0.52 . . . . 22.26 109.881 178.448 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 45.0 m-70 -83.23 171.95 13.09 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.65 -0.5 . . . . 22.51 109.65 178.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 11.1 p80 -120.64 85.04 2.32 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.593 0.711 . . . . 24.89 110.867 -178.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 183' ' ' HIS . . . . . 0.437 ' O ' ' HB2' ' A' ' 184' ' ' HIS . 87.3 m-70 -93.5 -29.24 15.63 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.687 -0.688 . . . . 25.58 110.634 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.437 ' HB2' ' O ' ' A' ' 183' ' ' HIS . 50.0 m-70 73.75 -30.48 0.21 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.521 0.728 . . . . 27.37 112.089 -178.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 185' ' ' HIS . . . . . 0.415 ' H ' ' C ' ' A' ' 183' ' ' HIS . 68.0 m80 . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.299 -0.857 . . . . 29.06 110.95 179.081 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.28 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -116.84 5.93 18.18 Favored Glycine 0 N--CA 1.448 -0.553 0 O-C-N 121.596 -0.69 . . . . 2.97 112.12 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.526 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . 24.3 m -128.3 -136.84 0.23 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.637 0.256 . . . . 1.94 110.586 -178.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.995 HG23 ' H ' ' B' 1005 ' ' GLY . 4.2 m 43.98 -98.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.218 -0.572 0 CA-C-O 117.281 -1.343 . . . . 1.63 111.571 -178.139 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 1005 ' ' GLY . . . . . 1.024 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . -39.34 -25.88 0.06 OUTLIER Glycine 0 CA--C 1.535 1.302 0 CA-C-N 120.188 1.358 . . . . 1.2 114.984 167.505 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 1006 ' ' ARG . . . . . 0.457 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 8.2 mpt_? -85.77 -33.83 21.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 117.635 0.717 . . . . 2.88 111.636 175.495 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 1007 ' ' ALA . . . . . 0.53 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -95.15 -55.58 3.02 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.527 0.566 . . . . 1.31 112.527 -167.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.671 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 2.9 mm? -65.89 -44.26 85.8 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.705 -0.48 . . . . 1.33 109.705 -175.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 1009 ' ' ALA . . . . . 0.965 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -42.93 -44.5 4.61 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 122.474 1.13 . . . . 0.88 110.502 172.095 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.878 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -79.92 -51.16 9.45 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 113.467 -1.697 . . . . 1.03 111.204 -175.796 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 1011 ' ' PHE . . . . . 0.568 ' HE2' ' H8 ' ' B' 1100 ' ' 33B . 42.6 m-85 -66.61 -19.84 65.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.152 -0.476 . . . . 1.67 110.913 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 1012 ' ' GLY . . . . . 0.908 ' HA2' ' HZ ' ' A' ' 57' ' ' PHE . . . -82.23 -2.6 90.62 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 116.006 -0.543 . . . . 0.78 113.033 -178.046 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 39.0 t70 -88.6 7.1 35.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.539 0.685 . . . . 1.9 109.933 170.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 2.7 m -113.71 91.29 3.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.949 -0.568 . . . . 1.44 110.158 178.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.483 HD11 ' O ' ' B' 1012 ' ' GLY . 0.8 OUTLIER -132.17 -97.83 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.155 0.502 . . . . 2.91 109.965 179.268 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 54.9 t30 -135.16 105.66 6.42 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.242 -0.651 . . . . 4.29 109.242 177.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -98.49 -72.58 0.65 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.735 -0.666 . . . . 8.17 111.154 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.57 0 O-C-N 122.271 -0.268 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.878 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.8 tpt . . . . . 0 N--CA 1.484 1.24 0 CA-C-O 120.83 0.348 . . . . 6.21 110.653 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.9 m -160.67 -51.06 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.001 -0.545 . . . . 1.87 110.585 -179.885 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.413 ' O ' ' HB3' ' A' ' 6' ' ' ARG . 2.0 mp0 -72.54 -10.26 59.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.364 -0.38 . . . . 2.42 111.091 179.916 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.2 p -63.96 -37.19 86.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.477 -0.329 . . . . 1.25 111.137 -179.791 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.622 ' HA ' HD13 ' A' ' 8' ' ' LEU . 23.9 p30 -64.65 -17.11 63.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.684 0.278 . . . . 1.78 110.869 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.519 ' NH1' ' HA ' ' A' ' 128' ' ' ALA . 9.9 tpp180 -60.22 -39.7 87.56 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.056 0.455 . . . . 1.4 109.85 178.999 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -64.41 -42.54 96.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.625 -0.716 . . . . 0.68 110.423 179.579 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.622 HD13 ' HA ' ' A' ' 5' ' ' ASN . 8.9 mp -54.36 -39.56 67.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.812 -0.631 . . . . 1.16 110.401 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.422 HG13 ' HE2' ' A' ' 130' ' ' MET . 91.6 t -73.37 -64.8 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.927 -0.579 . . . . 0.27 110.086 178.98 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.418 HG21 ' OE2' ' A' ' 31' ' ' GLU . 52.4 t -44.8 -66.77 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.254 -0.884 . . . . 0.33 112.178 -179.969 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -43.32 -33.58 1.03 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.59 112.137 -179.226 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.44 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.2 t80 -77.33 -46.68 22.15 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.107 -0.237 . . . . 1.61 111.221 -179.556 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.654 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 10.0 mp -60.45 -37.51 81.2 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.948 0.404 . . . . 0.34 110.525 179.536 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.46 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 38.3 t -68.13 -42.51 80.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.873 -0.603 . . . . 1.05 110.195 179.635 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -68.9 -24.28 64.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.713 -0.676 . . . . 1.22 110.442 179.596 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.541 ' HG3' HG21 ' A' ' 112' ' ' VAL . 1.9 tppt? -85.34 -16.52 39.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.942 -0.572 . . . . 1.41 110.775 -179.761 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 mp -90.04 -13.92 34.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.072 -0.513 . . . . 1.35 110.116 179.263 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 72.6 m -75.27 -35.88 61.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.788 -0.642 . . . . 0.94 110.728 179.702 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -70.55 -4.84 25.04 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.318 -0.401 . . . . 1.37 110.473 179.769 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.462 ' HG3' HG13 ' A' ' 112' ' ' VAL . 29.7 mmmt -109.51 -26.04 10.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.849 -0.614 . . . . 2.2 110.775 -179.845 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.03 4.29 44.88 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.841 -0.695 . . . . 0.53 111.98 -179.402 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -102.1 160.9 14.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.854 0.359 . . . . 0.76 110.855 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.1 t -110.79 138.73 46.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.063 -0.517 . . . . 0.52 110.573 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.46 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 11.6 t90 -68.01 -45.36 74.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.066 -0.516 . . . . 3.36 111.085 -179.934 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.463 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 50.9 m -56.96 -41.68 78.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 1.37 111.834 -179.369 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -56.59 -24.02 44.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.298 -0.41 . . . . 1.11 112.044 -179.227 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.402 ' CG ' ' HB3' ' A' ' 120' ' ' GLN . 29.1 m-85 -126.7 16.0 7.52 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.878 0.325 . . . . 1.28 111.878 -179.08 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.539 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 83.6 p -99.9 -179.99 4.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.12 0.486 . . . . 1.81 111.413 -179.792 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.465 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 9.7 t70 -166.07 -15.34 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.394 -0.821 . . . . 2.31 109.868 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.701 HG23 ' H ' ' A' ' 31' ' ' GLU . 0.6 OUTLIER -58.58 -75.99 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.319 -0.855 . . . . 0.92 111.809 -179.833 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.701 ' H ' HG23 ' A' ' 30' ' ' VAL . 42.8 mt-10 -87.5 -3.43 59.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.927 0.394 . . . . 2.74 110.682 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.465 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 38.7 tt0 -67.96 -46.63 70.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 1.45 111.367 -179.627 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -93.39 -57.95 2.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.315 -0.402 . . . . 1.87 111.553 -179.432 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 18.0 ptt180 -100.42 156.37 17.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.919 0.39 . . . . 3.39 111.283 -179.691 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 68.0 p -118.63 93.28 4.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.87 -0.605 . . . . 2.25 110.737 179.854 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -74.08 -85.64 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.949 -0.569 . . . . 3.34 111.47 -179.629 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -88.01 158.52 49.94 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.805 -0.634 . . . . 1.92 111.319 -179.358 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.509 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 39.1 Cg_exo -61.14 -176.15 0.15 Allowed 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.335 2.023 . . . . 1.87 111.846 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -75.52 -18.44 59.8 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.05 -0.523 . . . . 4.64 110.978 -179.971 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 170.06 55.13 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.474 -0.87 . . . . 2.15 113.024 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.607 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.7 OUTLIER -56.62 -59.17 5.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.95 0.405 . . . . 1.12 110.491 179.273 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.607 ' H ' HG23 ' A' ' 41' ' ' THR . 12.2 pt-20 -124.07 -19.6 5.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.423 0.63 . . . . 2.02 109.377 179.084 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.739 ' HA ' HG22 ' A' ' 46' ' ' VAL . 27.1 m -72.77 -23.34 60.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.918 -1.037 . . . . 1.25 112.409 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -52.28 -36.36 52.59 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.094 0.405 . . . . 1.91 112.094 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.452 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -91.81 -36.17 13.68 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.172 0.434 . . . . 0.52 112.172 -179.024 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.739 HG22 ' HA ' ' A' ' 43' ' ' SER . 1.5 m -75.27 -28.12 20.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 111.876 0.324 . . . . 1.41 111.876 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.6 ptmt -77.94 -34.21 51.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.887 0.375 . . . . 0.67 110.121 -179.794 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.495 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 68.5 mm-40 -68.61 -36.32 78.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.861 -0.609 . . . . 0.99 109.423 178.745 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.445 ' HB2' HG23 ' A' ' 152' ' ' VAL . . . -77.59 -31.7 53.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.532 -0.758 . . . . 0.42 109.47 178.544 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.566 HD21 ' CD2' ' A' ' 104' ' ' PHE . 28.9 tp -67.41 -31.65 72.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.972 -1.013 . . . . 1.33 110.082 179.39 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -70.06 -40.45 75.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.263 -0.881 . . . . 2.17 110.543 179.6 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.9 -45.97 69.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.927 -0.579 . . . . 1.1 110.707 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.99 -36.54 83.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 0.53 110.925 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.442 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -72.0 -37.88 60.14 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.811 -0.709 . . . . 0.7 112.395 -179.985 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -55.35 -43.81 75.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.69 0.281 . . . . 1.04 111.386 -179.798 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -72.65 -16.68 61.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.335 -0.393 . . . . 2.29 111.49 -179.602 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -90.33 -31.46 16.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.578 -0.283 . . . . 2.29 111.26 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.442 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 49.2 mt-10 -63.84 -60.79 2.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.428 -0.351 . . . . 1.3 111.549 -179.523 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.469 HD12 ' N ' ' A' ' 60' ' ' ARG . 3.8 pp -54.97 -20.42 9.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.055 -0.521 . . . . 1.54 111.758 -179.347 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.469 ' N ' HD12 ' A' ' 59' ' ' LEU . 23.4 ttm180 -66.66 -38.5 86.97 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.2 0.445 . . . . 2.58 112.2 -178.818 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -129.63 15.15 5.97 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.133 -0.227 . . . . 5.32 111.449 -179.389 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.408 ' HA ' ' HB3' ' A' ' 65' ' ' PHE . 29.3 ttm180 -50.49 -47.0 57.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.501 -0.318 . . . . 4.48 111.642 -179.685 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -32.33 54.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.171 -0.468 . . . . 4.72 111.61 -179.2 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.421 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -91.22 -26.51 18.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.909 0.385 . . . . 1.17 111.083 179.903 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.534 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -58.31 -39.25 78.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.944 -0.571 . . . . 2.81 111.635 -179.33 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 69.6 m -76.5 -25.7 54.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.798 0.332 . . . . 2.19 111.16 -179.881 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -93.7 -12.33 29.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.155 -0.475 . . . . 2.72 111.045 -179.463 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.421 HD13 ' O ' ' A' ' 64' ' ' ALA . 2.2 mp -80.91 -9.04 59.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 1.56 111.143 -179.491 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.433 HG22 ' OE1' ' A' ' 113' ' ' GLU . 46.0 p -59.8 -31.03 69.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.7 110.874 179.765 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -77.01 -36.88 55.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.962 -0.563 . . . . 1.34 110.74 179.842 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -74.53 -23.62 58.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 1.42 110.534 179.78 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.457 HD11 ' HZ ' ' A' ' 106' ' ' PHE . 44.7 mt -92.87 -18.22 23.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.811 -0.632 . . . . 1.37 110.989 -179.903 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 m80 55.69 49.46 16.3 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 110.117 -0.327 . . . . 2.72 110.117 -179.081 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.535 HG13 ' HB3' ' A' ' 113' ' ' GLU . 37.8 mm -49.56 93.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.991 -0.549 . . . . 0.91 110.968 -179.755 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.556 ' O ' ' HB2' ' A' ' 79' ' ' ALA . 0.4 OUTLIER -130.94 164.6 40.96 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 115.478 -0.783 . . . . 0.51 110.028 -179.368 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.515 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 12.4 Cg_endo -55.62 142.07 82.58 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.191 1.928 . . . . 0.47 113.61 -179.234 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.702 ' H ' HD11 ' A' ' 122' ' ' LEU . . . 63.92 -77.56 0.05 OUTLIER Glycine 0 CA--C 1.52 0.401 0 CA-C-N 115.464 -0.789 . . . . 0.4 114.828 178.17 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 58.9 p -55.05 -4.83 0.08 Allowed 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 113.652 0.982 . . . . 0.56 113.652 -177.931 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.556 ' HB2' ' O ' ' A' ' 75' ' ' THR . . . -60.11 -24.8 64.95 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 121.483 0.659 . . . . 0.34 109.233 178.447 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -69.1 -32.83 72.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.83 -1.077 . . . . 4.13 110.091 179.242 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.412 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 51.7 mt-30 -72.48 -25.47 61.44 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.269 0.557 . . . . 1.03 109.623 178.532 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.3 m -75.73 -40.44 55.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.442 -0.799 . . . . 0.48 108.9 178.548 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -74.89 -14.59 60.68 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.921 -1.036 . . . . 1.18 109.044 178.505 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.609 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.4 tt0 -67.77 -42.3 81.92 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.28 -0.873 . . . . 0.8 110.39 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -60.36 -25.62 65.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.034 -0.53 . . . . 1.62 110.618 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.408 HG21 ' CE2' ' A' ' 106' ' ' PHE . 41.4 t -87.31 -50.09 14.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.833 -0.621 . . . . 1.3 111.401 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.609 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.2 p -63.69 -26.85 41.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.444 -0.344 . . . . 0.85 111.107 -179.719 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -67.14 -39.14 86.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.987 0.422 . . . . 0.91 110.535 179.632 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.699 ' HA ' ' HD2' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -89.93 -4.18 57.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.884 -0.598 . . . . 2.87 110.532 179.571 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.723 HD12 HH11 ' A' ' 99' ' ' ARG . 3.7 tp -93.59 9.21 37.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.736 -0.666 . . . . 1.28 111.291 -179.295 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.561 ' HA ' HG22 ' A' ' 95' ' ' VAL . 2.8 p90 -144.44 -28.66 0.49 Allowed 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.692 -0.403 . . . . 2.3 111.937 -179.992 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.699 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -77.8 -22.88 49.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.73 0.3 . . . . 5.06 110.971 -179.514 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.428 ' N ' ' HD3' ' A' ' 92' ' ' ARG . 19.9 t70 -88.92 2.49 53.72 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 3.12 110.62 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 113.66 109.91 2.91 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.855 -0.688 . . . . 2.31 112.389 -179.999 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.561 HG22 ' HA ' ' A' ' 91' ' ' PHE . 42.2 t -79.16 90.22 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.862 0.363 . . . . 1.06 111.01 179.99 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -89.48 178.34 6.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.048 -0.524 . . . . 2.12 110.348 179.653 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 22.1 m-90 -60.55 -60.57 3.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.032 0.444 . . . . 3.34 110.146 179.121 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.618 ' O ' HG22 ' A' ' 101' ' ' VAL . . . -64.45 -26.19 70.58 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.618 -0.719 . . . . 0.69 111.996 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.723 HH11 HD12 ' A' ' 90' ' ' LEU . 13.5 tpp180 -56.06 -36.04 67.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.21 0.528 . . . . 4.24 110.162 179.376 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.569 HG23 HD23 ' A' ' 138' ' ' LEU . 37.9 mt -71.99 -37.67 61.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.445 -0.798 . . . . 0.44 111.198 -179.775 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 98' ' ' GLY . 1.0 OUTLIER -63.23 -29.8 48.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.03 0.443 . . . . 1.35 109.958 179.616 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.19 -28.98 67.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.705 -0.68 . . . . 0.44 109.509 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.503 ' HB2' HD23 ' A' ' 90' ' ' LEU . 86.3 t80 -72.06 -22.27 61.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.97 -1.014 . . . . 1.49 110.207 179.455 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.566 ' CD2' HD21 ' A' ' 50' ' ' LEU . 72.2 m-85 -90.86 -46.02 8.45 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.773 -0.649 . . . . 3.29 111.201 179.765 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.44 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 19.7 p -62.01 -40.65 96.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.937 -0.574 . . . . 1.19 110.665 -179.954 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.457 ' HZ ' HD11 ' A' ' 72' ' ' LEU . 15.9 t80 -80.25 -41.91 24.19 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.18 -0.463 . . . . 2.89 110.591 179.864 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.91 -43.76 98.95 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.451 -0.88 . . . . 0.3 111.12 178.982 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.654 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -70.67 -28.65 70.57 Favored Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 110.591 -1.004 . . . . 0.23 110.591 178.449 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.534 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -70.55 -30.84 67.67 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.256 -0.646 . . . . 0.31 109.256 178.338 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.506 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -65.3 -33.74 76.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.446 -0.797 . . . . 1.12 108.896 178.851 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.504 ' SG ' HG13 ' A' ' 123' ' ' VAL . 3.2 t -68.12 -38.49 82.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.184 -0.916 . . . . 0.26 109.955 178.906 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.541 HG21 ' HG3' ' A' ' 16' ' ' LYS . 74.7 t -70.1 -39.23 76.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.725 -0.67 . . . . 0.35 110.534 179.339 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.535 ' HB3' HG13 ' A' ' 74' ' ' ILE . 31.0 mt-10 -67.65 -21.15 65.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.038 -0.528 . . . . 2.51 109.948 179.454 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.469 ' HB3' ' HB2' ' A' ' 122' ' ' LEU . 74.9 m -77.23 -50.16 13.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.677 -0.692 . . . . 0.28 109.867 179.07 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.536 HG23 ' HG3' ' A' ' 120' ' ' GLN . 3.4 p -66.65 -21.82 29.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.059 -0.519 . . . . 1.23 109.983 179.001 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -63.63 -37.85 88.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.64 -0.709 . . . . 0.6 110.492 179.477 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -93.69 22.29 5.64 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.992 -0.549 . . . . 1.62 110.716 179.898 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 67.77 22.32 8.9 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.205 -0.452 . . . . 1.88 110.936 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.495 ' SD ' ' HD3' ' A' ' 76' ' ' PRO . 10.4 mtm -114.77 78.01 1.12 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.251 -0.431 . . . . 0.31 110.506 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.536 ' HG3' HG23 ' A' ' 115' ' ' VAL . 13.9 mp0 -84.59 -3.5 58.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.474 -0.33 . . . . 1.15 111.668 -179.219 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.691 HG23 HD22 ' A' ' 122' ' ' LEU . 25.4 m -72.61 -5.91 7.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.855 0.36 . . . . 0.46 110.914 179.87 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.702 HD11 ' H ' ' A' ' 77' ' ' GLY . 4.1 mm? -93.09 -16.87 24.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.043 -0.526 . . . . 0.26 110.063 179.123 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.504 HG13 ' SG ' ' A' ' 111' ' ' CYS . 94.3 t -52.72 -59.08 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.786 -0.643 . . . . 0.25 111.074 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 124' ' ' SER . . . . . 0.539 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 37.5 t -65.83 -36.76 84.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.032 -0.531 . . . . 1.35 111.449 -179.692 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 125' ' ' ARG . . . . . 0.619 ' HD2' HD13 ' A' ' 122' ' ' LEU . 94.4 mtt180 -60.74 -67.12 0.43 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.507 -0.315 . . . . 2.67 111.248 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 126' ' ' ILE . . . . . 0.506 HD13 ' HB3' ' A' ' 110' ' ' LEU . 74.6 mt -44.82 -42.68 2.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.044 -0.525 . . . . 0.23 111.489 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.587 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.62 -42.52 78.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.416 -0.357 . . . . 0.29 111.057 179.855 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.519 ' HA ' ' NH1' ' A' ' 6' ' ' ARG . . . -69.13 -41.47 77.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.031 -0.531 . . . . 0.28 111.376 -179.963 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -64.31 -39.36 93.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.325 -0.398 . . . . 3.91 111.32 -179.778 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.422 ' HE2' HG13 ' A' ' 9' ' ' VAL . 89.2 mtp -65.16 -52.83 52.65 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.19 -0.459 . . . . 1.08 111.083 -179.574 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -57.8 -53.91 52.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.277 -0.419 . . . . 0.25 110.749 179.788 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.8 m -54.22 -49.73 68.76 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.052 -0.522 . . . . 0.4 111.066 179.869 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -57.03 -30.78 64.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.151 0.5 . . . . 3.13 110.052 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.619 ' O ' HD23 ' A' ' 134' ' ' LEU . 3.6 tt -81.28 -23.2 38.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.55 -0.75 . . . . 0.95 110.119 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -83.06 -6.91 59.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 0.46 112.06 -179.525 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -126.99 -30.47 2.71 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.126 0.787 . . . . 0.59 113.126 -178.148 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 8.3 m80 -107.54 -52.36 2.77 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.29 0.848 . . . . 1.45 113.29 -178.124 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.569 HD23 HG23 ' A' ' 100' ' ' ILE . 10.1 mp -80.84 -37.24 30.33 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.858 1.059 . . . . 1.2 113.858 -177.102 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.453 ' N ' ' HD2' ' A' ' 140' ' ' PRO . 34.8 tt0 -48.73 -53.84 32.88 Favored Pre-proline 0 N--CA 1.468 0.453 0 N-CA-C 112.407 0.521 . . . . 0.75 112.407 -178.073 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 140' ' ' PRO . . . . . 0.463 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 37.2 Cg_endo -65.6 -28.58 52.81 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.733 1.622 . . . . 0.56 112.272 -179.623 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 141' ' ' TRP . . . . . 0.444 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 1.2 t-105 -78.57 -30.01 46.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 1.2 111.155 -179.612 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 142' ' ' ILE . . . . . 0.681 HG22 ' HA2' ' A' ' 147' ' ' GLY . 60.5 mt -69.83 -40.22 78.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.969 -0.559 . . . . 0.32 110.656 -179.706 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 79.0 mm-40 -63.08 -28.68 70.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.519 . . . . 0.57 110.114 179.322 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 16.5 mm-40 -69.62 -23.8 63.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.847 -0.615 . . . . 0.78 110.235 179.301 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -97.51 -1.37 44.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.712 -0.676 . . . . 0.93 110.718 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.14 -35.91 3.61 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.869 -0.682 . . . . 0.56 112.812 179.758 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 147' ' ' GLY . . . . . 0.681 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 117.15 167.31 14.39 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.806 -0.711 . . . . 0.49 112.155 -179.741 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 148' ' ' TRP . . . . . 0.562 ' NE1' HD13 ' A' ' 142' ' ' ILE . 10.7 m-90 -57.76 -38.24 75.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.061 0.458 . . . . 3.57 110.176 179.459 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.445 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 32.5 t70 -60.34 -27.38 67.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.634 -0.712 . . . . 1.96 110.449 179.867 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 25.2 m -83.37 -25.38 31.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.273 0.558 . . . . 0.67 109.912 178.996 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -68.48 -35.2 77.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.481 -0.781 . . . . 3.0 110.383 179.547 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 152' ' ' VAL . . . . . 0.452 HG21 ' HB1' ' A' ' 45' ' ' ALA . 12.2 p -78.79 -2.17 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.436 0.636 . . . . 1.15 110.114 179.265 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 153' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 15.8 mm-40 -91.69 -18.02 24.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.809 -0.632 . . . . 1.67 109.7 178.657 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 22.7 mt -106.58 -52.88 2.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.488 -0.778 . . . . 1.3 110.393 179.714 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -109.0 27.82 9.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.577 -0.738 . . . . 4.24 110.943 -179.824 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 156' ' ' GLY . . . . . 0.439 ' HA2' HG23 ' A' ' 152' ' ' VAL . . . -46.78 152.46 1.32 Allowed Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.909 -0.587 . . . . 1.1 113.683 -179.324 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 157' ' ' ASN . . . . . 0.495 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 21.5 t-20 -60.69 116.72 4.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.624 -0.288 . . . . 1.29 110.661 179.719 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 158' ' ' ASN . . . . . 0.568 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 8.8 m120 -69.99 -24.82 63.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.334 -0.394 . . . . 2.99 111.701 -179.629 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.485 ' HB3' ' OD1' ' A' ' 157' ' ' ASN . . . -59.86 -26.06 65.54 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.014 0.435 . . . . 2.52 110.295 179.474 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -105.05 -34.16 8.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.757 -0.656 . . . . 2.87 110.396 179.297 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 161' ' ' ALA . . . . . 0.568 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -61.17 -44.18 97.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.998 -0.546 . . . . 3.2 110.022 179.239 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -69.6 -34.73 74.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.569 -0.742 . . . . 3.72 109.659 178.966 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 46.8 t -59.82 -40.25 87.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.836 -0.62 . . . . 4.18 109.486 178.967 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 164' ' ' ARG . . . . . 0.433 ' O ' ' HG3' ' A' ' 168' ' ' GLU . 8.1 mpt_? -77.57 -30.97 52.88 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.566 -0.743 . . . . 5.82 109.683 178.697 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -70.24 -27.9 64.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.636 -0.711 . . . . 4.77 109.874 179.39 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 166' ' ' GLY . . . . . 0.485 ' O ' ' HB2' ' A' ' 169' ' ' ARG . . . -64.48 -53.99 32.1 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.573 -0.74 . . . . 5.1 111.5 179.568 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -63.33 -17.79 62.94 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.047 -0.723 . . . . 5.72 109.047 178.597 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.55 ' HG2' ' HA ' ' A' ' 173' ' ' HIS . 39.4 mt-10 -88.82 42.34 1.07 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.173 -0.921 . . . . 5.88 109.938 178.861 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.485 ' HB2' ' O ' ' A' ' 166' ' ' GLY . 0.0 OUTLIER -127.73 -70.59 0.69 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.403 -0.817 . . . . 7.34 109.727 179.105 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.538 ' C ' ' H ' ' A' ' 172' ' ' HIS . 3.2 mm? -66.79 -61.31 2.02 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 109.226 -0.657 . . . . 6.97 109.226 178.959 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.45 -0.56 2.8 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 107.89 -1.152 . . . . 6.97 107.89 177.495 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 172' ' ' HIS . . . . . 0.538 ' H ' ' C ' ' A' ' 170' ' ' LEU . 1.3 t-80 76.81 -62.84 0.4 Allowed 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 114.323 -1.308 . . . . 9.35 110.517 179.384 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 173' ' ' HIS . . . . . 0.584 ' ND1' ' HB3' ' A' ' 175' ' ' HIS . 0.6 OUTLIER 162.83 -153.13 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.477 -1.305 . . . . 11.4 107.477 179.598 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 174' ' ' HIS . . . . . 0.644 ' HE2' ' HB3' ' A' ' 180' ' ' HIS . 0.3 OUTLIER -48.46 -16.64 0.11 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.266 -0.642 . . . . 11.52 109.266 178.351 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 175' ' ' HIS . . . . . 0.643 ' HB2' ' H ' ' A' ' 180' ' ' HIS . 0.0 OUTLIER -38.25 -27.26 0.02 OUTLIER 'General case' 0 C--O 1.212 -0.875 0 CA-C-N 115.256 -0.884 . . . . 14.48 111.598 178.525 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 176' ' ' HIS . . . . . 0.628 ' ND1' ' N ' ' A' ' 177' ' ' HIS . 15.0 p80 -35.79 -41.01 0.2 Allowed 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.914 -0.773 . . . . 15.37 108.914 179.157 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 177' ' ' HIS . . . . . 0.628 ' N ' ' ND1' ' A' ' 176' ' ' HIS . 0.1 OUTLIER -81.61 45.2 0.86 Allowed 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 107.53 -1.285 . . . . 16.02 107.53 177.843 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.626 ' HB3' ' ND1' ' A' ' 183' ' ' HIS . 0.9 OUTLIER 71.94 130.84 0.04 OUTLIER 'General case' 0 N--CA 1.44 -0.952 0 N-CA-C 108.3 -1.0 . . . . 17.99 108.3 -176.577 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 179' ' ' GLU . . . . . 0.734 ' HB2' ' HE2' ' A' ' 183' ' ' HIS . 0.3 OUTLIER -13.5 120.3 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.662 0 O-C-N 124.09 0.869 . . . . 19.19 111.799 -179.064 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 180' ' ' HIS . . . . . 0.644 ' HB3' ' HE2' ' A' ' 174' ' ' HIS . 0.0 OUTLIER 7.09 -59.78 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.461 0 O-C-N 125.224 1.577 . . . . 22.26 114.028 179.968 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 181' ' ' HIS . . . . . 0.708 ' N ' ' O ' ' A' ' 179' ' ' GLU . 12.0 m-70 -130.37 -32.76 1.74 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.855 -0.611 . . . . 22.51 110.256 -179.285 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 182' ' ' HIS . . . . . 0.625 ' HB2' ' HB3' ' A' ' 179' ' ' GLU . 0.7 OUTLIER -61.88 141.76 57.78 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.016 -0.993 . . . . 24.89 109.447 -179.934 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 183' ' ' HIS . . . . . 0.734 ' HE2' ' HB2' ' A' ' 179' ' ' GLU . 5.8 p80 44.16 14.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 O-C-N 124.064 0.853 . . . . 25.58 110.284 -177.216 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 184' ' ' HIS . . . . . 0.562 ' H ' ' C ' ' A' ' 182' ' ' HIS . 8.4 t-80 -116.28 161.14 19.45 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 114.614 -1.175 . . . . 27.37 108.065 179.818 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 185' ' ' HIS . . . . . 0.533 ' NE2' ' HB3' ' A' ' 181' ' ' HIS . 1.3 p-80 . . . . . 0 C--O 1.247 0.929 0 O-C-N 124.203 0.939 . . . . 29.06 111.654 179.51 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.092 . . . . . . . . 4.05 . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -94.66 2.22 66.92 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.694 -0.765 . . . . 2.97 112.625 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1003 ' ' CYS . . . . . 0.519 ' O ' ' N ' ' B' 1005 ' ' GLY . 72.8 m -94.42 -142.91 0.24 Allowed 'General case' 0 C--N 1.328 -0.34 0 O-C-N 122.877 -0.19 . . . . 1.94 110.972 -179.829 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B 1004 ' ' VAL . . . . . 0.67 HG23 ' H ' ' B' 1005 ' ' GLY . 1.7 m 43.22 -80.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 123.307 0.643 . . . . 1.63 112.298 -179.63 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B 1005 ' ' GLY . . . . . 0.684 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . -48.6 -23.02 2.98 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 121.002 -0.618 . . . . 1.2 112.858 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -110.11 -40.61 4.67 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.835 0.35 . . . . 2.88 111.188 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1007 ' ' ALA . . . . . 0.491 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -56.95 -76.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.008 -0.542 . . . . 1.31 112.22 -179.197 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B 1008 ' ' LEU . . . . . 0.546 HD22 ' H ' ' B' 1008 ' ' LEU . 3.3 mm? -50.99 -35.2 32.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 1.33 111.846 -178.875 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B 1009 ' ' ALA . . . . . 0.624 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -62.8 -38.87 92.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.121 0.486 . . . . 0.88 110.977 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B 1010 ' ' ALA . . . . . 0.668 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -79.95 -52.64 7.59 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.577 -0.738 . . . . 1.03 111.704 -179.306 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -60.31 -25.42 65.76 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.805 0.336 . . . . 1.67 110.763 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.88 9.15 12.01 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 121.007 -0.616 . . . . 0.78 112.787 -179.829 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 20.7 t70 -105.16 -5.15 20.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.988 0.423 . . . . 1.9 110.405 179.748 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 5.1 m -97.7 -1.14 44.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.862 -0.608 . . . . 1.44 111.239 -179.585 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B 1015 ' ' ILE . . . . . 0.561 ' HB ' ' HA3' ' A' ' 98' ' ' GLY . 1.6 pp -64.36 -11.35 10.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 112.209 0.448 . . . . 2.91 112.209 -179.399 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B 1016 ' ' ASN . . . . . 0.563 ' HB3' ' NH1' ' B' 1017 ' ' ARG . 6.2 t-20 -59.05 -68.48 0.27 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.675 0.274 . . . . 4.29 110.456 -179.737 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B 1017 ' ' ARG . . . . . 0.563 ' NH1' ' HB3' ' B' 1016 ' ' ASN . 0.0 OUTLIER -177.25 -163.73 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.371 -0.377 . . . . 8.17 110.868 179.325 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.664 -0.244 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B 1100 ' ' 33B . . . . . 0.668 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 . . . . . 0 N--CA 1.468 0.437 0 N-CA-C 112.137 0.421 . . . . 2.4199999999999999 112.137 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.2 m -65.17 -18.05 64.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.833 0.349 . . . . 1.25 110.815 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.597 ' HB2' HD13 ' A' ' 134' ' ' LEU . 4.9 p30 -59.0 -27.25 65.25 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.055 -0.521 . . . . 1.78 111.01 173.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.586 ' O ' HG23 ' A' ' 10' ' ' VAL . 8.7 tpp85 -58.93 -47.76 83.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.814 -0.63 . . . . 1.3999999999999999 110.278 177.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -54.46 -47.71 72.6 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 115.316 -0.857 . . . . 0.68000000000000005 110.867 -179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.437 HD22 HG22 ' A' ' 46' ' ' VAL . 6.2 mt -57.77 -40.16 79.14 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.5 -1.227 . . . . 1.1599999999999999 109.814 -173.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.4 t -67.53 -59.68 3.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.552 -0.749 . . . . 0.27000000000000002 110.196 174.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 6' ' ' ARG . 63.4 t -53.6 -50.86 47.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.117 -0.947 . . . . 0.33000000000000002 112.633 -174.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.6 -37.21 70.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.872 0.367 . . . . 0.58999999999999997 110.876 -176.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.706 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 35.3 t80 -73.6 -47.18 42.31 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 116.297 -0.41 . . . . 1.6100000000000001 110.793 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.877 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.7 mp -59.13 -38.04 78.67 Favored 'General case' 0 C--O 1.228 -0.075 0 C-N-CA 120.249 -0.58 . . . . 0.34000000000000002 109.797 178.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.448 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 26.3 m -55.27 -50.42 69.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 1.05 110.853 175.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -64.62 -32.06 73.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.003 -0.544 . . . . 1.22 110.461 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.625 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 7.6 mmpt? -63.94 -43.99 94.21 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 115.974 -0.557 . . . . 1.4099999999999999 111.353 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.657 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.4 OUTLIER -71.55 -30.2 65.61 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 120.178 -0.609 . . . . 1.3500000000000001 110.079 178.633 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.6 t -60.81 -40.23 91.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.638 -0.71 . . . . 0.93999999999999995 111.24 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -78.91 0.3 27.9 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.959 0.409 . . . . 1.3700000000000001 112.014 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.652 ' HE2' HG11 ' A' ' 112' ' ' VAL . 19.0 mmmt -111.6 -27.08 8.71 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.899 0.857 . . . . 2.2000000000000002 109.123 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.79 20.29 11.87 Favored Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 114.097 -1.411 . . . . 0.53000000000000003 111.663 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -108.18 167.38 10.05 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.37 -0.604 . . . . 0.76000000000000001 109.37 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.42 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 3.9 t -110.42 144.42 39.24 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 121.084 0.468 . . . . 0.52000000000000002 110.359 176.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.448 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.8 OUTLIER -74.44 -48.36 28.0 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.53 -0.759 . . . . 3.3599999999999999 109.787 175.06 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.471 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 2.5 p -66.19 -31.46 72.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.035 -0.53 . . . . 1.3700000000000001 111.92 -173.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.42 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 89.9 mt-30 -61.71 -25.33 67.36 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.259 0.552 . . . . 1.1100000000000001 111.148 177.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -121.35 17.64 11.42 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.559 -0.746 . . . . 1.28 111.058 -176.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.567 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 54.1 p -100.24 -178.13 3.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.484 0.659 . . . . 1.8100000000000001 112.415 -171.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.615 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 6.7 t70 -171.97 -23.81 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.378 -1.283 . . . . 2.3100000000000001 109.069 -178.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.831 HG23 ' H ' ' A' ' 31' ' ' GLU . 7.1 m -47.17 -70.83 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 114.274 -1.33 . . . . 0.92000000000000004 112.643 -174.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.831 ' H ' HG23 ' A' ' 30' ' ' VAL . 8.7 pt-20 -100.6 1.16 40.5 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.53 0.681 . . . . 2.7400000000000002 109.245 175.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.615 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 31.1 tt0 . . . . . 0 N--CA 1.45 -0.455 0 CA-C-N 114.814 -1.085 . . . . 1.45 110.894 -176.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.81 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.8 OUTLIER . . . . . 0 CA--C 1.535 0.372 0 CA-C-O 120.602 0.239 . . . . 1.1200000000000001 110.488 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.81 ' H ' HG23 ' A' ' 41' ' ' THR . 15.2 pt-20 -93.68 -31.94 14.25 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 122.343 1.068 . . . . 2.02 108.935 170.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.952 ' HA ' HG13 ' A' ' 46' ' ' VAL . 66.6 m -59.17 -25.91 64.33 Favored 'General case' 0 C--O 1.209 -1.027 0 CA-C-N 113.315 -1.766 . . . . 1.25 113.496 -170.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -43.96 -38.89 3.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 118.131 0.423 . . . . 1.9099999999999999 111.56 -177.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.409 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -86.06 -42.35 14.02 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.567 0.21 . . . . 0.52000000000000002 111.567 174.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.952 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.6 m -68.33 -41.92 83.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 120.908 -0.317 . . . . 1.4099999999999999 111.796 -175.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.795 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.0 ptpt -68.4 -36.26 78.85 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.154 -0.684 . . . . 0.67000000000000004 109.154 178.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.521 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 5.1 mm100 -61.16 -36.52 80.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.587 -0.733 . . . . 0.98999999999999999 111.405 174.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.625 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -75.7 -40.66 55.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.673 0.749 . . . . 0.41999999999999998 110.177 175.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.559 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -56.65 -40.71 75.94 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.722 -1.126 . . . . 1.3300000000000001 112.113 -178.92 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.544 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 7.5 ptp180 -75.44 -29.89 59.84 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.774 0.797 . . . . 2.1699999999999999 109.617 -169.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 32.9 mm-40 -72.51 -48.3 41.63 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.283 -1.326 . . . . 1.1000000000000001 109.852 179.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.57 -36.99 85.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.557 -0.747 . . . . 0.53000000000000003 110.355 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.585 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -61.89 -42.36 99.73 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.912 -0.585 . . . . 0.69999999999999996 111.782 176.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -58.64 -42.98 89.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.005 0.431 . . . . 1.04 110.517 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -57.41 -28.26 63.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.394 -0.821 . . . . 2.29 111.239 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.496 ' CZ ' HD12 ' B' 1008 ' ' LEU . 17.2 t80 -82.2 -39.4 23.18 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.221 -0.445 . . . . 2.29 110.983 178.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.705 ' HA ' ' CE2' ' A' ' 61' ' ' TYR . 40.2 mt-10 -60.52 -63.69 1.21 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.138 -0.483 . . . . 1.3 112.21 -168.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.636 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -49.64 -37.46 28.35 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 123.673 0.608 . . . . 1.54 112.342 -178.399 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.636 ' H ' HD12 ' A' ' 59' ' ' LEU . 63.6 mtt180 -63.6 -44.54 93.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.172 -0.467 . . . . 2.5800000000000001 111.728 -177.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.705 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 5.5 p90 -90.95 -7.81 51.03 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 120.654 -0.418 . . . . 5.3200000000000003 111.506 -179.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -58.28 -26.0 62.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 4.4800000000000004 111.385 -174.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -55.87 -46.26 78.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.046 -0.525 . . . . 4.7199999999999998 110.937 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.701 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.85 -32.7 15.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.409 -0.36 . . . . 1.1699999999999999 111.498 -178.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.697 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 47.5 t80 -42.91 -46.92 5.54 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.735 1.013 . . . . 2.8100000000000001 113.735 -171.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.2 p -68.13 -27.53 66.52 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.92 0.391 . . . . 2.1899999999999999 111.608 -175.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -90.42 -29.21 18.14 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.023 -0.535 . . . . 2.7200000000000002 111.552 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 65.1 mt -66.48 -17.77 64.99 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.894 0.702 . . . . 1.5600000000000001 112.894 -171.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.641 HG22 HG13 ' A' ' 74' ' ' ILE . 8.6 p -61.24 -24.77 66.6 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.429 0.633 . . . . 0.69999999999999996 110.694 -176.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.0 m -74.95 -29.71 61.01 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.847 -1.069 . . . . 1.3400000000000001 110.501 176.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.575 ' NE2' HD22 ' A' ' 68' ' ' LEU . 12.6 mt-30 -82.0 -49.47 10.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.475 -0.784 . . . . 1.4199999999999999 110.504 -177.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.699 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.7 mp -66.17 -28.77 69.03 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.086 -0.709 . . . . 1.3700000000000001 109.086 176.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 67.9 t60 64.45 55.26 1.39 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 122.244 1.021 . . . . 2.7200000000000002 108.253 -176.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.641 HG13 HG22 ' A' ' 69' ' ' THR . 15.5 mm -57.42 112.04 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 113.628 -1.624 . . . . 0.91000000000000003 110.666 -178.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.781 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.5 -167.45 0.16 Allowed Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 107.424 -1.324 . . . . 0.51000000000000001 107.424 -169.12 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.781 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.0 Cg_exo -29.03 165.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.303 0 C-N-CA 124.636 3.558 . . . . 0.46999999999999997 115.037 162.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -34.61 -24.63 0.01 OUTLIER Glycine 0 N--CA 1.474 1.208 0 N-CA-C 117.221 1.648 . . . . 0.40000000000000002 117.221 -171.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 76' ' ' PRO . 40.1 p -69.1 3.37 2.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 117.956 0.878 . . . . 0.56000000000000005 112.096 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.11 -14.15 62.2 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.274 0.559 . . . . 0.34000000000000002 109.961 173.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -78.12 -15.82 58.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.567 . . . . 4.1299999999999999 109.543 176.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.497 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 36.5 mt-30 -87.87 -22.62 24.32 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.801 0.81 . . . . 1.03 109.672 173.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.528 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 5.8 m -72.35 -48.71 39.67 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.617 -1.174 . . . . 0.47999999999999998 109.293 170.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.5 ' O ' HG13 ' A' ' 86' ' ' VAL . 84.8 t80 -70.69 -15.59 62.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.021 -0.991 . . . . 1.1799999999999999 110.047 173.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.662 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.1 tt0 -64.7 -49.07 72.35 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.167 0.508 . . . . 0.80000000000000004 110.276 175.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.416 ' H ' ' HG3' ' A' ' 85' ' ' GLN . 64.1 mt-30 -43.07 -44.8 5.02 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.525 -1.216 . . . . 1.6200000000000001 111.318 178.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.966 ' HA ' ' HA2' ' B' 1005 ' ' GLY . 0.9 OUTLIER -86.15 -44.53 16.74 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.335 0 CA-C-N 113.835 -1.53 . . . . 1.3 111.829 -172.645 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.662 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.8 p -62.23 -23.53 32.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.98 0.895 . . . . 0.84999999999999998 109.876 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.73 -48.52 74.31 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.357 -1.292 . . . . 0.91000000000000003 110.917 176.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.714 ' HB3' ' HB2' ' B' 1009 ' ' ALA . 5.6 mm-40 -69.15 -43.56 74.06 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-O 122.443 1.116 . . . . 2.8700000000000001 108.815 178.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.597 ' HG ' ' NH1' ' A' ' 99' ' ' ARG . 8.4 tp -54.86 -24.98 25.71 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 112.312 -2.222 . . . . 1.28 111.518 -173.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.506 ' O ' HG23 ' A' ' 95' ' ' VAL . 76.1 t80 -100.04 -35.67 9.62 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.637 0.732 . . . . 2.2999999999999998 110.935 -173.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.544 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 7.5 ptm180 -77.82 -35.26 51.5 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.502 -0.772 . . . . 5.0599999999999996 111.42 -172.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -93.22 20.64 6.74 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.411 -0.813 . . . . 3.1200000000000001 112.753 -169.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.584 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 128.02 68.59 0.14 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 117.167 -2.444 . . . . 2.3100000000000001 115.935 174.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.569 ' HA ' ' HE ' ' A' ' 99' ' ' ARG . 67.8 t -73.31 98.43 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 118.649 1.225 . . . . 1.0600000000000001 111.611 177.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.409 ' ND2' ' N ' ' A' ' 96' ' ' ASN . 1.0 OUTLIER -112.45 -170.78 1.73 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.327 -1.306 . . . . 2.1200000000000001 108.996 179.582 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.754 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 22.5 m-90 -63.63 -63.54 1.14 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.9 0.381 . . . . 3.3399999999999999 110.666 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.427 ' O ' HG22 ' A' ' 101' ' ' VAL . . . -67.11 -26.66 73.35 Favored Glycine 0 C--O 1.225 -0.411 0 CA-C-N 115.933 -0.576 . . . . 0.68999999999999995 112.723 -177.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.598 ' HD2' ' O ' ' A' ' 99' ' ' ARG . 1.7 tmm_? -58.23 -40.16 80.95 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.936 0.398 . . . . 4.2400000000000002 110.268 178.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 52.6 mt -67.8 -28.18 40.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.522 -0.308 . . . . 0.44 111.656 -175.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.445 ' O ' ' HD1' ' A' ' 104' ' ' PHE . 0.8 OUTLIER -64.03 -25.88 39.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.308 0.575 . . . . 1.3500000000000001 110.079 176.472 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.482 ' HA ' ' CD2' ' A' ' 57' ' ' PHE . . . -66.94 -39.79 87.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.735 0.779 . . . . 0.44 110.327 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.463 ' HB2' HH12 ' A' ' 99' ' ' ARG . 28.0 t80 -64.0 -46.17 85.74 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.366 -1.288 . . . . 1.49 110.914 -178.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.595 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.1 OUTLIER -80.36 -18.69 48.29 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.529 -0.468 . . . . 3.29 110.553 -178.283 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.706 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 35.3 t -75.17 -57.5 3.85 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.383 -0.371 . . . . 1.1899999999999999 110.59 178.369 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -68.3 -24.19 64.82 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 109.498 -0.556 . . . . 2.8900000000000001 109.498 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.469 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -67.12 -42.3 91.8 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.69 -0.767 . . . . 0.29999999999999999 111.467 172.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.877 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.82 -31.29 79.28 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.66 -0.781 . . . . 0.23000000000000001 111.396 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.697 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -75.2 -33.05 61.37 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.69 -0.255 . . . . 0.31 110.553 176.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -39.4 83.62 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 107.956 -1.127 . . . . 1.1200000000000001 107.956 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.771 ' SG ' HG22 ' A' ' 123' ' ' VAL . 29.9 t -49.57 -62.92 1.28 Allowed 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 113.368 -1.742 . . . . 0.26000000000000001 110.204 172.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.887 ' HA ' HG13 ' A' ' 115' ' ' VAL . 46.8 t -63.18 -34.54 67.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.384 -0.371 . . . . 0.34999999999999998 111.48 -176.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.62 ' HB3' HG21 ' A' ' 74' ' ' ILE . 36.7 mt-10 -55.91 -25.32 42.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.097 0.475 . . . . 2.5099999999999998 110.418 176.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.44 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 65.0 m -85.0 -41.46 15.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.485 -0.931 . . . . 0.28000000000000003 108.485 -178.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.887 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.4 m -69.14 -29.74 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.349 0 CA-C-N 114.734 -1.121 . . . . 1.23 109.422 -177.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -51.31 -51.03 58.01 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.205 -1.816 . . . . 0.59999999999999998 111.563 175.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -83.52 10.59 8.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.724 -0.671 . . . . 1.6200000000000001 109.743 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.613 ' HA ' ' NE2' ' A' ' 120' ' ' GLN . 36.0 mt-10 63.31 55.82 1.79 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 122.159 0.981 . . . . 1.8799999999999999 109.805 -176.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 24.6 mtm -134.96 37.36 3.04 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.848 -1.524 . . . . 0.31 107.553 179.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.702 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 4.9 mp0 -52.28 -7.36 0.06 Allowed 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 114.903 -1.044 . . . . 1.1499999999999999 113.353 -178.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.447 HG23 HD22 ' A' ' 122' ' ' LEU . 27.0 m -67.41 -22.41 28.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 121.464 -0.773 . . . . 0.46000000000000002 111.921 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.715 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.5 mm? -71.6 -24.77 61.95 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.014 0.435 . . . . 0.26000000000000001 109.928 178.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.771 HG22 ' SG ' ' A' ' 111' ' ' CYS . 42.3 t -44.92 -49.38 2.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 114.716 -1.129 . . . . 0.25 112.593 -177.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.567 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 8.9 t -78.22 -34.83 49.07 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.44 -0.504 . . . . 1.3500000000000001 110.58 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.715 ' HD2' HD13 ' A' ' 122' ' ' LEU . 66.5 mtt180 -62.85 -49.27 75.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.002 -0.545 . . . . 2.6699999999999999 110.418 -176.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.547 HD12 ' HA ' ' A' ' 111' ' ' CYS . 73.6 mt -57.82 -52.19 60.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.488 -0.778 . . . . 0.23000000000000001 110.767 178.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.748 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -54.07 -36.68 63.4 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 123.291 0.37 . . . . 0.28999999999999998 111.339 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.46 -56.13 23.54 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.357 0.599 . . . . 0.28000000000000003 111.054 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -72.57 -23.7 61.0 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.225 -0.898 . . . . 3.9100000000000001 111.627 -174.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.545 ' SD ' HG22 ' A' ' 126' ' ' ILE . 88.8 mtp -66.01 -58.72 4.87 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.1 0.476 . . . . 1.0800000000000001 110.343 174.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.96 -35.65 79.09 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.704 -0.68 . . . . 0.25 110.702 -178.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.6 m -63.47 -46.7 84.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.411 -0.359 . . . . 0.40000000000000002 110.95 176.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -56.69 -39.12 73.25 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.858 -0.423 . . . . 3.1299999999999999 109.858 177.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.949 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.9 tt -62.77 -50.98 68.9 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.985 -0.746 . . . . 0.94999999999999996 108.985 174.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -51.46 -49.54 61.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.673 0.62 . . . . 0.46000000000000002 112.673 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -83.15 -51.29 7.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.041 0.448 . . . . 0.58999999999999997 112.103 -176.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -91.4 -50.46 5.79 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 113.121 0.786 . . . . 1.45 113.121 -170.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.949 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -80.61 -45.05 17.93 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.564 0.95 . . . . 1.2 113.564 -168.323 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.605 ' HA ' HD12 ' A' ' 142' ' ' ILE . 28.1 tt0 -47.47 -50.4 49.82 Favored Pre-proline 0 C--N 1.322 -0.612 0 O-C-N 123.686 0.616 . . . . 0.75 112.526 -175.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.576 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 51.8 Cg_exo -52.99 -50.26 14.69 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 121.746 1.63 . . . . 0.56000000000000005 111.734 176.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -58.83 -48.16 82.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.587 -0.733 . . . . 1.2 110.513 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.605 HD12 ' HA ' ' A' ' 139' ' ' GLU . 43.9 mt -49.92 -50.96 17.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.058 -0.519 . . . . 0.32000000000000001 111.351 176.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.58 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 79.2 mm-40 -60.21 -31.45 70.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.559 -0.746 . . . . 0.56999999999999995 111.587 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.7 mm-40 -65.41 -20.71 66.49 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 121.519 0.676 . . . . 0.78000000000000003 110.685 177.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.414 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 18.1 m-80 -111.47 5.84 19.83 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.088 -0.96 . . . . 0.93000000000000005 110.371 -174.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.01 -47.08 1.06 Allowed Glycine 0 N--CA 1.441 -1.006 0 CA-C-N 115.318 -0.855 . . . . 0.56000000000000005 113.294 173.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . 0.559 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 130.16 -172.39 20.24 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.48 -0.867 . . . . 0.48999999999999999 112.064 -177.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 9.0 m-90 -76.08 -35.5 59.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.529 0.204 . . . . 3.5699999999999998 110.742 -177.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -59.1 -43.94 91.91 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.176 0.512 . . . . 1.96 109.702 175.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.593 ' O ' HD13 ' A' ' 154' ' ' LEU . 95.8 m -60.1 -34.48 73.54 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.29 -0.868 . . . . 0.67000000000000004 111.021 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.754 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 90.0 t80 -60.68 -41.44 95.09 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.482 -0.487 . . . . 3.0 110.212 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.512 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.5 m -76.03 -26.94 17.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.916 0.389 . . . . 1.1499999999999999 110.486 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' A' ' 150' ' ' THR . 7.8 mm-40 -56.0 -47.95 76.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.342 0.592 . . . . 1.6699999999999999 109.56 170.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.593 HD13 ' O ' ' A' ' 150' ' ' THR . 7.4 mp -78.25 -61.25 2.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.2 -0.909 . . . . 1.3 112.902 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -120.83 29.64 7.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.303 0.573 . . . . 4.2400000000000002 110.423 -168.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.625 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -58.92 166.19 7.89 Favored Glycine 0 CA--C 1.506 -0.473 0 CA-C-N 115.476 -0.784 . . . . 1.1000000000000001 114.115 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.501 ' ND2' HE21 ' A' ' 48' ' ' GLN . 26.9 t-20 . . . . . 0 C--N 1.314 -0.97 0 CA-C-N 113.835 -1.182 . . . . 1.29 111.038 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . 0.966 ' HA2' ' HA ' ' A' ' 86' ' ' VAL . . . . . . . . 0 N--CA 1.435 -1.405 0 N-CA-C 110.287 -1.125 . . . . 1.2 110.287 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -61.08 -42.16 97.99 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.932 0.345 . . . . 2.8799999999999999 111.932 177.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -70.91 -49.5 45.1 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.342 0.497 . . . . 1.3100000000000001 112.342 -171.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.722 ' HB2' HG23 ' A' ' 86' ' ' VAL . 2.1 mm? -73.82 -34.93 64.78 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.055 -0.258 . . . . 1.3300000000000001 110.425 -178.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 0.714 ' HB2' ' HB3' ' A' ' 89' ' ' GLU . . . -47.22 -47.52 24.47 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.983 0.897 . . . . 0.88 110.377 168.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -79.82 -58.42 3.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 114.026 -1.443 . . . . 1.03 111.881 -174.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -61.65 -19.21 62.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 1.6699999999999999 111.15 -178.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.92 -25.08 72.52 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 121.033 -0.603 . . . . 0.78000000000000003 113.106 -178.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 31.1 t70 -77.05 5.83 7.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.411 0.624 . . . . 1.8999999999999999 110.513 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 35.3 m . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.028 -0.533 . . . . 1.4399999999999999 111.092 -178.69 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.438 ' O ' ' HB3' ' A' ' 6' ' ' ARG . 24.3 mp0 . . . . . 0 CA--C 1.522 -0.107 0 CA-C-O 121.021 0.439 . . . . 2.4199999999999999 110.651 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.528 ' O ' ' HG ' ' A' ' 8' ' ' LEU . 5.1 p -68.7 -32.2 71.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.095 -0.502 . . . . 1.25 111.176 178.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.823 ' HB3' HD13 ' A' ' 134' ' ' LEU . 50.6 m-20 -62.15 -26.66 68.45 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.077 0.465 . . . . 1.78 110.127 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.567 ' O ' HG23 ' A' ' 10' ' ' VAL . 16.9 tpp85 -57.47 -49.36 76.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.491 -0.777 . . . . 1.3999999999999999 109.81 176.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -57.23 -44.99 84.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.528 -0.76 . . . . 0.68000000000000005 111.085 178.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.557 HD22 HG22 ' A' ' 46' ' ' VAL . 8.8 mt -60.65 -29.39 69.24 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.583 -1.189 . . . . 1.1599999999999999 110.117 -174.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.551 HG21 ' N ' ' A' ' 131' ' ' ALA . 55.9 t -80.65 -59.62 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 115.05 -0.977 . . . . 0.27000000000000002 110.161 173.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 6' ' ' ARG . 99.4 t -52.28 -54.59 13.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.38 -0.827 . . . . 0.33000000000000002 112.466 -175.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -56.85 -35.86 69.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.996 0.427 . . . . 0.58999999999999997 110.355 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.532 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 8.2 t80 -72.38 -48.0 45.03 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.84 -0.618 . . . . 1.6100000000000001 110.469 -178.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.85 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.5 mp -61.66 -42.21 98.6 Favored 'General case' 0 C--N 1.338 0.098 0 C-N-CA 120.793 -0.363 . . . . 0.34000000000000002 110.516 177.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.8 t -58.97 -45.52 90.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.12 -0.491 . . . . 1.05 110.142 177.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -59.37 -33.83 71.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.469 -0.787 . . . . 1.22 110.936 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.712 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 8.6 mmpt? -75.96 -30.96 58.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.379 -0.373 . . . . 1.4099999999999999 111.932 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.552 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -70.25 -27.78 64.71 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.261 -0.576 . . . . 1.3500000000000001 110.265 176.511 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -58.8 -43.41 90.54 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.879 -0.601 . . . . 0.93999999999999995 112.315 -178.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -72.45 -2.75 20.68 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.28 0.562 . . . . 1.3700000000000001 111.551 -177.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.603 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 18.3 mmmt -109.64 -26.25 9.99 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.945 0.879 . . . . 2.2000000000000002 109.014 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.14 22.1 11.04 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 113.829 -1.532 . . . . 0.53000000000000003 111.171 178.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.603 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 95.1 m-85 -114.17 165.52 12.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.942 0.401 . . . . 0.76000000000000001 110.827 -179.036 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.8 t -110.92 141.33 44.48 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.758 -0.656 . . . . 0.52000000000000002 109.906 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -65.72 -46.12 80.13 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.113 -0.494 . . . . 3.3599999999999999 110.01 174.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.3 p -64.75 -36.52 84.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.748 -0.66 . . . . 1.3700000000000001 111.836 -172.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.69 -31.01 69.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.073 0.463 . . . . 1.1100000000000001 111.24 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.502 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 15.8 m-85 -112.54 13.54 20.08 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.892 -0.594 . . . . 1.28 110.441 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.568 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 79.8 p -96.76 -179.29 4.53 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 121.69 0.757 . . . . 1.8100000000000001 111.511 -176.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.496 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.2 t70 -164.86 -26.06 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.98 -1.464 . . . . 2.3100000000000001 107.753 -177.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.938 HG23 ' H ' ' A' ' 31' ' ' GLU . 8.9 m -59.81 -75.11 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 113.734 -1.575 . . . . 0.92000000000000004 112.331 -177.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.938 ' H ' HG23 ' A' ' 30' ' ' VAL . 12.3 mm-40 -80.72 -7.87 59.49 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.618 -0.882 . . . . 2.7400000000000002 108.618 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 25.2 tt0 . . . . . 0 N--CA 1.443 -0.792 0 CA-C-N 114.174 -1.376 . . . . 1.45 110.528 177.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.825 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.3 t . . . . . 0 CA--C 1.54 0.569 0 CA-C-O 120.594 0.235 . . . . 1.1200000000000001 110.725 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.825 ' H ' HG23 ' A' ' 41' ' ' THR . 15.9 pt-20 -95.56 -26.5 15.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.589 1.185 . . . . 2.02 108.762 167.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.774 ' HB2' ' HE3' ' A' ' 47' ' ' LYS . 1.4 p -55.78 -39.67 71.57 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 112.407 -2.179 . . . . 1.25 114.56 -169.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -39.66 -53.74 2.13 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.895 0.747 . . . . 1.9099999999999999 112.792 -169.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.15 -36.24 58.86 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.94 0.348 . . . . 0.52000000000000002 111.94 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.622 ' HB ' ' HB3' ' A' ' 148' ' ' TRP . 0.8 OUTLIER -69.98 -44.88 78.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 121.012 -0.275 . . . . 1.4099999999999999 110.888 -176.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.774 ' HE3' ' HB2' ' A' ' 43' ' ' SER . 18.1 ptpt -64.16 -41.28 97.22 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.422 -0.584 . . . . 0.67000000000000004 109.422 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.696 HE21 ' HA ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -56.89 -34.93 68.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.357 -0.838 . . . . 0.98999999999999999 111.545 174.296 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.714 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -78.61 -33.86 47.11 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.234 0.54 . . . . 0.41999999999999998 110.501 178.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 12.5 mt -63.38 -33.66 76.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.484 -0.78 . . . . 1.3300000000000001 112.306 -177.165 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.658 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.3 ptp180 -79.49 -29.25 41.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.592 0.71 . . . . 2.1699999999999999 109.178 -174.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -70.27 -43.78 69.77 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.29 -1.323 . . . . 1.1000000000000001 110.655 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.28 -43.68 69.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.823 -0.626 . . . . 0.53000000000000003 110.526 176.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.633 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.66 -39.09 96.1 Favored Glycine 0 C--O 1.226 -0.346 0 CA-C-N 115.852 -0.613 . . . . 0.69999999999999996 111.815 178.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -53.59 -43.58 68.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.024 0.44 . . . . 1.04 110.463 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.675 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 37.5 mt-10 -69.97 -38.4 76.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.891 -0.595 . . . . 2.29 111.268 177.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.515 ' HE2' ' CZ ' ' A' ' 106' ' ' PHE . 7.3 t80 -65.16 -33.0 74.98 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.363 -0.381 . . . . 2.29 110.773 -174.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.633 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 33.6 mt-10 -65.35 -47.14 77.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.16 -0.473 . . . . 1.3 110.793 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' A' ' 56' ' ' GLU . 4.6 pp -68.67 -31.26 70.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 1.54 110.638 -179.28 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.705 ' HB3' ' SG ' ' B' 1014 ' ' CYS . 47.3 mtt180 -68.77 -35.94 77.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.586 0.708 . . . . 2.5800000000000001 110.186 178.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.704 ' HB3' ' HB3' ' A' ' 65' ' ' PHE . 0.2 OUTLIER -91.5 0.04 57.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.925 -1.034 . . . . 5.3200000000000003 112.089 -177.718 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -35.81 -39.44 0.15 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.125 1.158 . . . . 4.4800000000000004 114.125 -172.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.405 ' HD2' HH11 ' A' ' 63' ' ' ARG . 34.6 ttm180 -75.46 -42.98 51.9 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 122.181 -0.324 . . . . 4.7199999999999998 111.7 -175.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.52 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -91.91 -41.19 10.73 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.786 0.661 . . . . 1.1699999999999999 112.786 -174.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.704 ' HB3' ' HB3' ' A' ' 61' ' ' TYR . 5.5 p90 -49.49 -40.71 38.39 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.524 0.935 . . . . 2.8100000000000001 113.524 -164.12 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.5 t -91.03 -42.36 10.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.934 0.397 . . . . 2.1899999999999999 110.39 -177.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -59.2 -28.64 66.83 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.619 0.723 . . . . 2.7200000000000002 110.955 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.635 ' O ' HD12 ' A' ' 72' ' ' LEU . 1.8 mp -62.42 -17.06 58.41 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.029 -0.987 . . . . 1.5600000000000001 113.263 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.698 HG22 HG13 ' A' ' 74' ' ' ILE . 12.6 p -62.65 -22.9 66.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 118.397 0.544 . . . . 0.69999999999999996 112.058 -175.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.7 t -76.15 -35.14 59.35 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.017 -0.735 . . . . 1.3400000000000001 109.017 174.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.501 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 9.0 mt-30 -69.2 -47.41 64.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.816 -1.084 . . . . 1.4199999999999999 109.785 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.635 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mt -70.53 -32.02 69.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.602 -0.726 . . . . 1.3700000000000001 110.109 177.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 60.74 63.95 1.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.999 0.904 . . . . 2.7200000000000002 108.861 -172.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.761 HG21 ' HB3' ' A' ' 113' ' ' GLU . 29.3 mm -60.64 115.05 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 114.006 -1.452 . . . . 0.91000000000000003 111.382 -178.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.773 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -155.58 -172.26 0.31 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 107.963 -1.125 . . . . 0.51000000000000001 107.963 -171.463 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.773 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 17.8 Cg_exo -31.05 167.36 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.327 0 C-N-CA 125.029 3.819 . . . . 0.46999999999999997 115.091 165.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.501 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.85 -27.16 0.01 OUTLIER Glycine 0 N--CA 1.476 1.331 0 N-CA-C 117.372 1.709 . . . . 0.40000000000000002 117.372 -174.176 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.458 ' N ' ' O ' ' A' ' 76' ' ' PRO . 24.9 p -68.48 -0.36 4.92 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 117.909 0.855 . . . . 0.56000000000000005 111.925 177.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.32 -14.75 62.72 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.295 0.569 . . . . 0.34000000000000002 109.621 170.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -73.33 -25.99 60.85 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.577 -0.738 . . . . 4.1299999999999999 109.553 173.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.448 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 78.2 mt-30 -80.71 -31.98 35.94 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.902 0.858 . . . . 1.03 109.092 177.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.3 m -63.62 -54.21 39.43 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.015 -1.448 . . . . 0.47999999999999998 110.005 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.47 ' HA ' HG23 ' A' ' 86' ' ' VAL . 79.7 t80 -70.41 -18.49 63.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.365 -0.834 . . . . 1.1799999999999999 110.717 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.608 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.6 tt0 -59.21 -50.25 74.76 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.692 -0.686 . . . . 0.80000000000000004 110.46 176.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.488 ' O ' ' HG2' ' A' ' 89' ' ' GLU . 80.5 mt-30 -47.62 -32.45 5.57 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.596 -1.184 . . . . 1.6200000000000001 110.769 175.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.998 HG13 ' HG ' ' B' 1008 ' ' LEU . 1.6 t -84.1 -54.7 8.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-N 114.552 -1.203 . . . . 1.3 110.879 -176.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.608 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.3 p -60.69 -29.65 45.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.83 -0.623 . . . . 0.84999999999999998 109.989 -176.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.734 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 0.7 OUTLIER -58.22 -50.09 74.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.758 -1.11 . . . . 0.91000000000000003 110.687 175.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 1.002 ' HB3' ' HB2' ' B' 1009 ' ' ALA . 35.7 mm-40 -64.26 -42.79 96.32 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 122.331 1.062 . . . . 2.8700000000000001 109.391 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.489 HD12 ' HA ' ' A' ' 90' ' ' LEU . 0.3 OUTLIER -58.14 -25.48 61.49 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 112.692 -2.049 . . . . 1.28 112.814 -165.906 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.597 ' HA ' HG22 ' A' ' 95' ' ' VAL . 15.9 p90 -106.28 -22.15 12.91 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.62 -0.432 . . . . 2.2999999999999998 112.071 -174.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.734 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.7 OUTLIER -94.24 -29.59 15.01 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-O 121.257 0.551 . . . . 5.0599999999999996 111.298 -175.557 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.561 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 37.6 t70 -90.31 7.48 38.19 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.637 -0.71 . . . . 3.1200000000000001 112.685 -168.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 129.59 70.63 0.12 Allowed Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 117.125 -2.464 . . . . 2.3100000000000001 114.345 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.597 HG22 ' HA ' ' A' ' 91' ' ' PHE . 48.6 t -71.65 101.52 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 122.399 1.095 . . . . 1.0600000000000001 111.302 -179.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.475 ' H ' ' CB ' ' A' ' 99' ' ' ARG . 0.7 OUTLIER -111.47 -179.87 3.83 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 113.745 -1.57 . . . . 2.1200000000000001 108.293 177.877 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.573 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 5.1 m95 -60.93 -52.43 65.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.81 0.338 . . . . 3.3399999999999999 111.002 177.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.88 -20.0 75.69 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.926 -0.654 . . . . 0.68999999999999995 112.697 -179.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.475 ' CB ' ' H ' ' A' ' 96' ' ' ASN . 4.7 tpp180 -67.24 -40.61 86.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.404 0.621 . . . . 4.2400000000000002 110.015 179.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.533 HG22 ' CE2' ' A' ' 104' ' ' PHE . 69.8 mt -72.17 -39.39 64.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.407 -0.815 . . . . 0.44 110.125 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 97' ' ' TRP . 55.2 t -53.44 -46.99 59.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.837 -0.619 . . . . 1.3500000000000001 110.233 172.278 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 99' ' ' ARG . . . -49.31 -51.71 32.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.179 -0.918 . . . . 0.44 110.888 174.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -54.63 -44.52 73.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.252 -0.886 . . . . 1.49 110.961 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.562 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 57.3 m-85 -64.77 -43.27 93.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.646 0.26 . . . . 3.29 111.146 176.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.515 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 27.3 m -60.9 -49.97 75.31 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.181 -0.463 . . . . 1.1899999999999999 110.864 -177.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.515 ' CZ ' ' HE2' ' A' ' 57' ' ' PHE . 33.0 m-85 -72.23 -33.63 67.7 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.399 -0.364 . . . . 2.8900000000000001 110.875 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.706 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -69.07 -41.63 80.37 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.569 -0.825 . . . . 0.29999999999999999 111.879 177.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.85 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.46 -37.55 90.12 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.75 -0.738 . . . . 0.23000000000000001 111.483 176.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.21 -28.54 64.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.768 0.318 . . . . 0.31 110.482 176.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.607 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -64.02 -43.17 96.42 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 108.209 -1.034 . . . . 1.1200000000000001 108.209 179.286 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.661 ' HB2' HD23 ' A' ' 13' ' ' LEU . 19.5 t -53.27 -55.03 27.85 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 113.861 -1.518 . . . . 0.26000000000000001 110.534 173.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.437 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 71.8 t -63.36 -41.28 92.16 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-N 116.127 -0.488 . . . . 0.34999999999999998 111.624 -178.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.761 ' HB3' HG21 ' A' ' 74' ' ' ILE . 37.2 mm-40 -63.7 -21.95 66.66 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.052 0.453 . . . . 2.5099999999999998 111.254 178.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.523 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 36.9 m -76.2 -40.86 51.24 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.618 -0.882 . . . . 0.28000000000000003 108.618 172.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 111' ' ' CYS . 81.0 t -66.62 -37.37 79.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.967 0.889 . . . . 1.23 109.628 -178.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -52.41 -50.21 62.96 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 113.38 -1.736 . . . . 0.59999999999999998 111.37 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.507 ' HE2' ' O ' ' A' ' 113' ' ' GLU . 11.2 mmtt -90.73 14.96 12.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.491 . . . . 1.6200000000000001 110.525 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 63.55 53.12 2.14 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.81 0.814 . . . . 1.8799999999999999 111.075 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.543 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 25.5 mtm -130.1 44.27 2.99 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.804 -1.089 . . . . 0.31 108.073 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.494 ' HG2' HG13 ' A' ' 115' ' ' VAL . 4.5 mt-30 -60.92 -7.57 2.51 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.786 -1.097 . . . . 1.1499999999999999 113.068 -174.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.534 HG23 HD22 ' A' ' 122' ' ' LEU . 35.0 m -65.43 -26.04 38.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 122.225 -0.297 . . . . 0.46000000000000002 111.089 175.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.74 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -72.51 -27.75 62.45 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.463 -0.335 . . . . 0.26000000000000001 110.536 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.633 HG22 ' SG ' ' A' ' 111' ' ' CYS . 68.0 t -43.65 -53.03 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 O-C-N 123.968 0.793 . . . . 0.25 111.936 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.568 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 10.3 t -72.14 -40.46 68.04 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.748 0.309 . . . . 1.3500000000000001 110.932 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.74 ' HD2' HD13 ' A' ' 122' ' ' LEU . 92.0 mtt180 -59.98 -53.86 52.85 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 116.158 -0.474 . . . . 2.6699999999999999 110.589 -176.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.635 ' HA ' ' CZ2' ' A' ' 129' ' ' TRP . 87.2 mt -52.41 -48.4 45.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.361 -0.836 . . . . 0.23000000000000001 110.99 -178.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.563 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -60.14 -27.46 67.1 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.147 0.425 . . . . 0.28999999999999998 112.147 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.78 -61.41 2.08 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 121.486 0.66 . . . . 0.28000000000000003 110.358 -177.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.635 ' CZ2' ' HA ' ' A' ' 126' ' ' ILE . 27.3 p-90 -80.03 -18.07 51.13 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.169 -0.923 . . . . 3.9100000000000001 111.799 -176.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.706 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 12.4 mmm -58.12 -54.1 50.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.396 0.617 . . . . 1.0800000000000001 109.446 168.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.551 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -64.63 -41.52 96.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.586 -0.734 . . . . 0.25 110.888 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.541 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 70.1 m -57.9 -50.32 73.73 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.98 0.363 . . . . 0.40000000000000002 111.98 176.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.544 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 4.4 m-85 -59.34 -34.77 72.76 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.263 -0.175 . . . . 3.1299999999999999 111.194 -178.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.823 HD13 ' HB3' ' A' ' 5' ' ' ASN . 4.2 tt -62.02 -55.99 23.63 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.218 -1.03 . . . . 0.94999999999999996 108.218 170.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.0 m-80 -47.08 -51.3 18.01 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.114 -0.948 . . . . 0.46000000000000002 112.606 -178.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -84.76 -45.78 12.05 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.203 0.446 . . . . 0.58999999999999997 112.203 -173.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . 0.544 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 18.3 m-70 -91.02 -49.92 6.14 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.734 0.642 . . . . 1.45 112.734 -171.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 134' ' ' LEU . 46.7 mt -91.06 -36.75 13.85 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.784 0.661 . . . . 1.2 112.784 -165.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.637 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 31.5 tt0 -49.77 -50.73 65.7 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 123.54 0.525 . . . . 0.75 112.25 -173.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.597 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 35.2 Cg_exo -57.19 -49.84 12.9 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 121.61 1.54 . . . . 0.56000000000000005 111.494 176.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . 0.426 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 4.0 t-105 -57.74 -49.26 77.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.489 -0.778 . . . . 1.2 110.477 -178.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.619 HD12 ' HA ' ' A' ' 139' ' ' GLU . 47.0 mt -45.27 -53.32 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 122.953 0.501 . . . . 0.32000000000000001 111.655 173.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.637 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.7 mm-40 -59.4 -32.35 70.08 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.91 -0.586 . . . . 0.56999999999999995 111.513 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.2 mm-40 -66.42 -19.38 65.78 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.248 0.547 . . . . 0.78000000000000003 110.909 178.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -109.75 2.5 20.11 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.478 -0.783 . . . . 0.93000000000000005 110.725 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 126.87 -48.32 0.97 Allowed Glycine 0 N--CA 1.442 -0.961 0 CA-C-N 115.669 -0.696 . . . . 0.56000000000000005 113.075 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 126.08 172.67 13.41 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.852 -0.69 . . . . 0.48999999999999999 111.45 -177.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.622 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 67.1 m95 -65.02 -36.42 84.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.901 0.351 . . . . 3.5699999999999998 111.611 -176.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.582 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 6.0 p-10 -59.95 -33.03 71.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.836 0.35 . . . . 1.96 110.634 177.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.547 ' O ' HD13 ' A' ' 154' ' ' LEU . 89.4 m -68.04 -39.99 82.93 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.047 -0.524 . . . . 0.67000000000000004 110.935 178.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.573 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 85.9 t80 -61.53 -33.03 73.13 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.942 -0.762 . . . . 3.0 108.942 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.582 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 99.0 t -63.08 -55.71 21.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-N 114.569 -1.196 . . . . 1.1499999999999999 110.786 174.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 9.5 mm-40 -47.76 -46.73 30.46 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.469 -0.787 . . . . 1.6699999999999999 111.538 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.547 HD13 ' O ' ' A' ' 150' ' ' THR . 8.4 mp -75.68 -61.18 2.01 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.233 0.827 . . . . 1.3 113.233 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -120.79 21.18 11.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.487 -0.324 . . . . 4.2400000000000002 111.822 -166.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.714 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -67.25 179.08 15.6 Favored Glycine 0 N--CA 1.45 -0.422 0 N-CA-C 115.729 1.051 . . . . 1.1000000000000001 115.729 -172.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 . . . . . 0 N--CA 1.441 -0.886 0 CA-C-N 113.208 -1.496 . . . . 1.29 110.683 -177.06 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.195 0 N-CA-C 112.774 -0.131 . . . . 1.2 112.774 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . 0.527 ' HA ' ' CZ ' ' B' 1006 ' ' ARG . 1.6 tpm_? -56.32 -52.3 65.07 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.707 0.765 . . . . 2.8799999999999999 111.669 172.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . 0.544 ' HB3' HD22 ' B' 1008 ' ' LEU . . . -99.67 -153.5 0.44 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.571 -1.195 . . . . 1.3100000000000001 110.063 -172.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.998 ' HG ' HG13 ' A' ' 86' ' ' VAL . 2.8 mm? 64.43 -74.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 O-C-N 123.963 0.789 . . . . 1.3300000000000001 111.384 174.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 1.002 ' HB2' ' HB3' ' A' ' 89' ' ' GLU . . . -46.06 -64.3 0.78 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.632 0.73 . . . . 0.88 110.574 169.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' B' 1013 ' ' ASP . . . -52.5 -40.06 61.97 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 114.597 -1.183 . . . . 1.03 112.43 -178.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . 0.418 ' O ' ' HB2' ' B' 1014 ' ' CYS . 80.6 m-85 -98.75 7.02 46.55 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.188 -0.46 . . . . 1.6699999999999999 111.297 -172.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.79 -16.89 79.16 Favored Glycine 0 CA--C 1.501 -0.787 0 N-CA-C 108.726 -1.75 . . . . 0.78000000000000003 108.726 166.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . 0.419 ' HB3' ' O ' ' B' 1010 ' ' ALA . 17.4 t70 -72.78 -2.88 22.19 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.36 -1.42 . . . . 1.8999999999999999 110.863 171.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . 0.705 ' SG ' ' HB3' ' A' ' 60' ' ' ARG . 15.3 t . . . . . 0 C--N 1.34 0.177 0 CA-C-O 121.334 0.588 . . . . 1.4399999999999999 110.057 178.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 20.7 mp0 . . . . . 0 N--CA 1.46 0.047 0 CA-C-O 120.865 0.364 . . . . 2.4199999999999999 111.257 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -20.67 66.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.3 -0.409 . . . . 1.25 111.461 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.947 ' HA ' HD22 ' A' ' 8' ' ' LEU . 70.1 m-20 -64.65 -22.35 66.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.21 -0.45 . . . . 1.78 110.477 178.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.835 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.2 tpp180 -54.81 -52.95 61.09 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.814 -0.63 . . . . 1.3999999999999999 110.449 176.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.824 ' HB3' ' HE3' ' A' ' 47' ' ' LYS . 46.9 mt-10 -57.94 -46.39 85.13 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.274 -0.876 . . . . 0.68000000000000005 110.905 -177.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.947 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.2 OUTLIER -52.77 -32.49 43.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.078 -0.965 . . . . 1.1599999999999999 111.217 179.304 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.5 HG21 ' CA ' ' A' ' 131' ' ' ALA . 67.7 t -80.24 -61.1 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.308 0.575 . . . . 0.27000000000000002 109.8 174.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.527 HG13 ' CE2' ' A' ' 24' ' ' TRP . 95.2 t -50.1 -54.77 7.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.815 -1.084 . . . . 0.33000000000000002 112.506 -175.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -49.24 -43.28 42.59 Favored 'General case' 0 CA--C 1.52 -0.205 0 O-C-N 123.472 0.482 . . . . 0.58999999999999997 110.57 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.617 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 1.6 t80 -72.43 -42.44 65.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.879 -0.6 . . . . 1.6100000000000001 111.077 -175.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.993 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.2 mp -62.75 -40.39 97.11 Favored 'General case' 0 C--O 1.231 0.124 0 C-N-CA 120.277 -0.569 . . . . 0.34000000000000002 110.185 177.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.7 m -62.57 -39.11 92.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.553 0.692 . . . . 1.05 109.929 176.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -63.81 -18.7 64.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.739 -1.118 . . . . 1.22 111.024 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.681 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.7 mmpt? -90.57 -52.77 4.73 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.31 0.576 . . . . 1.4099999999999999 110.054 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.61 HD23 HG22 ' A' ' 112' ' ' VAL . 13.6 mt -55.36 -31.41 61.73 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.687 -1.142 . . . . 1.3500000000000001 111.419 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.8 t -60.41 -31.1 70.07 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.962 -0.563 . . . . 0.93999999999999995 111.621 177.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -75.68 -21.42 57.64 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-O 121.792 0.806 . . . . 1.3700000000000001 110.448 -178.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.537 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 9.8 mmmt -96.45 -26.58 15.26 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.224 -1.353 . . . . 2.2000000000000002 108.665 -174.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.03 19.4 17.08 Favored Glycine 0 N--CA 1.437 -1.295 0 CA-C-N 113.744 -1.571 . . . . 0.53000000000000003 111.976 176.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.537 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 31.8 m-85 -99.63 154.9 17.91 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.753 0.311 . . . . 0.76000000000000001 110.343 177.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.0 t -92.29 142.81 27.05 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.998 -0.546 . . . . 0.52000000000000002 109.572 175.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.527 ' CE2' HG13 ' A' ' 10' ' ' VAL . 27.9 t-105 -74.5 -49.44 22.13 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.622 -0.51 . . . . 3.3599999999999999 109.622 176.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.8 m -58.94 -35.89 73.86 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.771 -0.65 . . . . 1.3700000000000001 111.725 -176.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -61.64 -25.78 67.58 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.894 0.378 . . . . 1.1100000000000001 111.965 -178.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -120.24 19.15 12.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.358 -0.383 . . . . 1.28 110.933 -178.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.459 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 37.4 p -100.26 -178.85 3.95 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.625 0.726 . . . . 1.8100000000000001 112.097 -172.153 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.519 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 5.4 t70 -161.52 -23.9 0.05 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.403 -1.271 . . . . 2.3100000000000001 108.899 -178.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.866 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.4 m -53.91 -72.43 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 114.269 -1.332 . . . . 0.92000000000000004 112.827 -175.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.866 ' H ' HG23 ' A' ' 30' ' ' VAL . 32.4 mt-10 -89.69 -4.26 57.82 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.632 -0.877 . . . . 2.7400000000000002 108.632 178.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.519 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 23.2 tt0 . . . . . 0 N--CA 1.443 -0.802 0 CA-C-N 114.45 -1.25 . . . . 1.45 111.222 -175.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.805 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.2 t . . . . . 0 CA--C 1.54 0.584 0 CA-C-O 120.537 0.208 . . . . 1.1200000000000001 110.547 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.805 ' H ' HG23 ' A' ' 41' ' ' THR . 14.2 pt-20 -92.88 -30.95 15.15 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 122.27 1.033 . . . . 2.02 108.315 168.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.456 ' HA ' HG13 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -56.57 -35.57 68.33 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 112.742 -2.027 . . . . 1.25 113.425 -170.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -45.17 -53.48 8.09 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 123.967 0.792 . . . . 1.9099999999999999 111.721 -173.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.453 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -72.39 -38.96 68.34 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.794 0.294 . . . . 0.52000000000000002 111.794 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.68 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 1.4 m -71.47 -41.71 72.92 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 120.939 -0.305 . . . . 1.4099999999999999 111.016 -175.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.824 ' HE3' ' HB3' ' A' ' 7' ' ' GLU . 0.4 OUTLIER -71.77 -30.24 65.35 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.298 -0.63 . . . . 0.67000000000000004 109.298 178.742 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.525 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 3.1 mm100 -64.61 -35.68 81.79 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.98999999999999999 110.266 172.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.643 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -75.65 -34.23 60.5 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.114 -0.493 . . . . 0.41999999999999998 110.597 176.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.68 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 12.5 mt -64.02 -28.0 69.5 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 115.514 -0.767 . . . . 1.3300000000000001 112.364 -176.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.501 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 7.9 ptm180 -81.07 -30.72 34.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.861 0.839 . . . . 2.1699999999999999 108.998 -176.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -74.99 -49.93 18.28 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.172 -1.376 . . . . 1.1000000000000001 109.786 -178.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.415 ' CB ' ' HZ ' ' A' ' 151' ' ' PHE . . . -65.45 -34.12 77.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.724 -0.671 . . . . 0.53000000000000003 109.87 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.761 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -58.7 -57.33 20.42 Favored Glycine 0 N--CA 1.442 -0.911 0 CA-C-N 115.262 -0.881 . . . . 0.69999999999999996 111.758 177.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -55.12 -43.16 73.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.807 0.337 . . . . 1.04 111.265 -177.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -59.5 -34.25 72.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.771 -0.65 . . . . 2.29 111.479 177.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.621 ' CE1' ' HA2' ' B' 1012 ' ' GLY . 67.0 t80 -81.6 -40.48 22.93 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.912 -0.585 . . . . 2.29 111.323 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.761 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 56.9 mt-10 -62.92 -42.19 99.72 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.314 -0.403 . . . . 1.3 111.745 -173.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.1 pp -59.73 -19.09 47.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.22 -0.446 . . . . 1.54 111.526 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 32.8 mtp-105 -79.7 -53.67 6.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.087 -0.506 . . . . 2.5800000000000001 110.953 -179.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.647 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 15.3 p90 -92.18 -5.72 52.04 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.672 0.619 . . . . 5.3200000000000003 112.672 -172.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.807 ' HG3' ' HE1' ' A' ' 65' ' ' PHE . 50.8 ttt180 -50.99 -38.49 51.45 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.28 0.474 . . . . 4.4800000000000004 112.28 -170.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -52.85 -38.14 61.11 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.051 0.389 . . . . 4.7199999999999998 112.051 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.427 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -82.78 -48.82 10.39 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 112.906 0.706 . . . . 1.1699999999999999 112.906 -172.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.807 ' HE1' ' HG3' ' A' ' 62' ' ' ARG . 5.1 p90 -60.04 -26.99 66.55 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.49 0.552 . . . . 2.8100000000000001 112.49 -166.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.1 t -68.02 -32.71 73.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.154 0.502 . . . . 2.1899999999999999 110.106 177.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -90.13 -25.82 20.5 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.583 0.706 . . . . 2.7200000000000002 110.397 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.69 ' O ' HD12 ' A' ' 72' ' ' LEU . 2.0 mp -75.31 -18.02 60.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.292 -0.867 . . . . 1.5600000000000001 112.424 -176.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.709 HG22 HG13 ' A' ' 74' ' ' ILE . 1.2 p -57.3 -34.42 68.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 118.147 0.431 . . . . 0.69999999999999996 111.043 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 45.6 t -63.88 -41.7 97.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.385 0.612 . . . . 1.3400000000000001 109.924 173.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.657 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 9.0 mt-30 -66.77 -39.12 87.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.113 -0.949 . . . . 1.4199999999999999 110.652 -178.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.69 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mt -76.2 -30.15 57.89 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.552 -0.749 . . . . 1.3700000000000001 110.408 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 68.55 50.72 0.67 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.447 0.642 . . . . 2.7200000000000002 109.616 -176.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.709 HG13 HG22 ' A' ' 69' ' ' THR . 25.5 mm -55.47 114.93 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.609 -1.178 . . . . 0.91000000000000003 111.419 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.765 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.95 -170.24 0.24 Allowed Pre-proline 0 CA--C 1.549 0.923 0 N-CA-C 107.514 -1.291 . . . . 0.51000000000000001 107.514 -171.566 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.765 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 32.2 Cg_exo -29.33 167.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.128 0 C-N-CA 125.218 3.945 . . . . 0.46999999999999997 115.326 162.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -28.56 -27.46 0.0 OUTLIER Glycine 0 N--CA 1.475 1.239 0 N-CA-C 117.828 1.891 . . . . 0.40000000000000002 117.828 -173.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.469 ' N ' ' O ' ' A' ' 76' ' ' PRO . 40.7 p -65.67 1.93 1.13 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 118.946 1.373 . . . . 0.56000000000000005 112.0 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.26 -12.16 60.76 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.551 -0.295 . . . . 0.34000000000000002 110.262 174.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.463 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 2.8 m-85 -73.62 -22.85 59.88 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.644 -0.872 . . . . 4.1299999999999999 108.644 174.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.408 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 33.5 mt-30 -81.95 -26.15 34.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.392 -0.822 . . . . 1.03 109.725 176.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.647 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 3.2 m -73.54 -51.51 16.72 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.63 -1.168 . . . . 0.47999999999999998 109.05 172.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.46 ' HB2' ' HG ' ' A' ' 110' ' ' LEU . 69.3 t80 -67.66 -17.89 64.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.115 -0.948 . . . . 1.1799999999999999 110.276 176.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.552 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.5 tt0 -61.64 -50.56 72.05 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.925 -0.579 . . . . 0.80000000000000004 110.409 177.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -47.23 -33.33 5.31 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 114.856 -1.066 . . . . 1.6200000000000001 110.311 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.872 HG13 HD12 ' B' 1008 ' ' LEU . 1.3 t -85.91 -55.13 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.981 0 CA-C-N 114.01 -1.45 . . . . 1.3 110.912 -174.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.552 HG12 ' HA ' ' A' ' 84' ' ' GLU . 4.9 p -62.86 -17.95 20.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-O 122.098 0.951 . . . . 0.84999999999999998 109.959 -176.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.547 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 4.5 m-80 -86.02 -35.58 20.26 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.148 -1.387 . . . . 0.91000000000000003 112.057 176.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 1.022 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.2 pp20? -74.65 -35.58 62.85 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 122.107 0.956 . . . . 2.8700000000000001 108.518 177.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.625 HD13 ' OE2' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -67.13 -33.36 75.28 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 113.569 -1.651 . . . . 1.28 110.879 -167.921 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.671 ' HA ' HG22 ' A' ' 95' ' ' VAL . 2.9 p90 -98.53 -16.62 19.09 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.774 -0.37 . . . . 2.2999999999999998 111.097 -174.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.615 ' CD ' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -88.81 -30.15 19.19 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.35 -0.54 . . . . 5.0599999999999996 111.139 -177.179 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -92.24 2.63 56.5 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.662 0.616 . . . . 3.1200000000000001 112.662 -168.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 131.67 71.78 0.1 OUTLIER Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 117.339 -2.362 . . . . 2.3100000000000001 114.954 -174.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.671 HG22 ' HA ' ' A' ' 91' ' ' PHE . 49.1 t -70.14 98.52 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 118.144 0.972 . . . . 1.0600000000000001 110.492 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.617 ' N ' HD22 ' A' ' 96' ' ' ASN . 0.7 OUTLIER -108.93 -179.06 3.75 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.311 -1.313 . . . . 2.1200000000000001 108.902 178.1 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.809 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 19.3 m-90 -51.37 -52.9 41.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.224 0.535 . . . . 3.3399999999999999 111.015 176.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.521 ' O ' ' HB ' ' A' ' 101' ' ' VAL . . . -81.36 -14.18 79.12 Favored Glycine 0 CA--C 1.519 0.324 0 CA-C-N 115.759 -0.655 . . . . 0.68999999999999995 113.637 -175.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.625 ' HD2' HD12 ' A' ' 90' ' ' LEU . 9.4 tpp180 -63.21 -42.4 99.28 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.291 0.567 . . . . 4.2400000000000002 110.496 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.569 HG22 ' CE2' ' A' ' 104' ' ' PHE . 89.8 mt -72.89 -33.61 44.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.671 . . . . 0.44 110.438 -179.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.521 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 72.8 t -49.1 -54.45 5.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.764 -0.653 . . . . 1.3500000000000001 109.804 168.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.423 ' HB1' ' CE2' ' A' ' 106' ' ' PHE . . . -52.49 -47.22 66.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.886 -1.052 . . . . 0.44 111.126 175.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.404 ' CE1' HG23 ' A' ' 87' ' ' VAL . 9.7 t80 -55.56 -39.67 70.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.579 -0.737 . . . . 1.49 111.395 178.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.569 ' CE2' HG22 ' A' ' 100' ' ' ILE . 30.7 m-85 -69.92 -33.74 72.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.632 0.253 . . . . 3.29 110.88 175.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.617 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 18.1 t -68.58 -53.84 20.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.484 -0.325 . . . . 1.1899999999999999 110.674 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.553 ' CZ ' ' HB3' ' B' 1008 ' ' LEU . 35.4 m-85 -63.98 -38.63 91.78 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-O 120.552 0.215 . . . . 2.8900000000000001 110.581 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -69.82 -39.18 76.32 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.619 -0.801 . . . . 0.29999999999999999 111.792 177.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.993 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.04 -36.19 91.63 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 111.303 -0.719 . . . . 0.23000000000000001 111.303 176.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -73.59 -29.14 62.21 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.229 -0.285 . . . . 0.31 110.229 175.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.46 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -61.3 -40.68 95.07 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 107.723 -1.214 . . . . 1.1200000000000001 107.723 178.155 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.717 ' SG ' HG22 ' A' ' 123' ' ' VAL . 39.9 t -51.57 -63.73 1.04 Allowed 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 113.612 -1.631 . . . . 0.26000000000000001 110.174 172.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.896 ' HA ' HG13 ' A' ' 115' ' ' VAL . 43.6 t -64.15 -37.89 81.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.202 0.445 . . . . 0.34999999999999998 112.202 -174.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.614 ' HB3' HG21 ' A' ' 74' ' ' ILE . 13.6 mm-40 -59.52 -16.95 27.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.185 0.517 . . . . 2.5099999999999998 110.767 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.578 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 63.9 m -85.1 -46.86 10.74 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 107.997 -1.112 . . . . 0.28000000000000003 107.997 176.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.896 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.7 m -66.38 -34.22 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-N 114.783 -1.099 . . . . 1.23 109.897 -174.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -50.32 -51.31 46.45 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 113.066 -1.879 . . . . 0.59999999999999998 111.153 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' ' 113' ' ' GLU . 24.1 mmtt -86.0 15.5 4.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.796 -0.638 . . . . 1.6200000000000001 110.109 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.496 ' HA ' ' NE2' ' A' ' 120' ' ' GLN . 39.0 mt-10 65.89 49.29 1.67 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 122.037 0.922 . . . . 1.8799999999999999 110.176 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.578 ' CE ' ' HA ' ' A' ' 114' ' ' SER . 27.9 mtm -129.59 37.12 4.02 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.329 -1.305 . . . . 0.31 107.889 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.771 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 1.9 mp0 -54.51 -8.05 0.2 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.921 -1.036 . . . . 1.1499999999999999 112.684 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.578 HG23 HD22 ' A' ' 122' ' ' LEU . 27.3 m -68.25 -22.5 27.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 O-C-N 122.102 -0.374 . . . . 0.46000000000000002 111.868 176.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.615 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.6 mm? -75.26 -24.89 57.66 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 120.956 0.408 . . . . 0.26000000000000001 110.137 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.717 HG22 ' SG ' ' A' ' 111' ' ' CYS . 46.7 t -45.19 -52.55 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 114.857 -1.065 . . . . 0.25 112.346 -176.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.459 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 0.1 OUTLIER -75.46 -33.59 60.86 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 121.044 0.449 . . . . 1.3500000000000001 111.196 -178.468 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.615 ' HD2' HD13 ' A' ' 122' ' ' LEU . 74.0 mtt180 -65.97 -52.5 49.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.67 -0.695 . . . . 2.6699999999999999 110.738 -176.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.553 HG22 ' SD ' ' A' ' 130' ' ' MET . 69.5 mt -53.6 -49.97 52.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.769 -0.651 . . . . 0.23000000000000001 111.331 179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.641 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.17 -32.53 68.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.624 -0.262 . . . . 0.28999999999999998 111.58 -177.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.835 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -58.75 -61.68 2.44 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.198 0.523 . . . . 0.28000000000000003 110.353 176.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -62.11 -35.67 79.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.86 -1.064 . . . . 3.9100000000000001 111.2 -176.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.553 ' SD ' HG22 ' A' ' 126' ' ' ILE . 88.2 mtp -60.86 -54.59 43.18 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.779 0.323 . . . . 1.0800000000000001 111.435 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.5 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -62.23 -43.01 99.79 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.26 -0.427 . . . . 0.25 111.004 -178.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 97.2 m -61.4 -44.39 97.23 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.838 -0.345 . . . . 0.40000000000000002 110.695 177.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.458 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 26.6 t80 -56.7 -40.24 75.27 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.153 -0.314 . . . . 3.1299999999999999 110.153 178.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.925 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 3.8 tt -61.42 -54.88 37.8 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.78 -0.822 . . . . 0.94999999999999996 108.78 174.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -51.75 -44.02 63.16 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.181 -0.918 . . . . 0.46000000000000002 112.426 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -84.68 -52.69 5.9 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.215 0.531 . . . . 0.58999999999999997 111.906 -175.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . 0.458 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 7.2 m80 -91.4 -51.77 5.12 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 113.124 0.787 . . . . 1.45 113.124 -171.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.925 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -80.74 -45.6 16.8 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.007 1.114 . . . . 1.2 114.007 -165.081 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.712 ' HA ' HD12 ' A' ' 142' ' ' ILE . 27.6 tt0 -44.99 -50.29 26.74 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 112.689 0.626 . . . . 0.75 112.689 -174.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.571 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 51.3 Cg_exo -54.38 -50.87 12.0 Favored 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 121.856 1.704 . . . . 0.56000000000000005 111.861 176.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 -58.02 -49.5 76.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.529 -0.759 . . . . 1.2 110.31 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.712 HD12 ' HA ' ' A' ' 139' ' ' GLU . 61.8 mt -46.58 -53.91 2.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.921 -0.581 . . . . 0.32000000000000001 111.683 175.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.563 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 72.3 mm-40 -60.14 -30.72 69.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.846 -0.616 . . . . 0.56999999999999995 111.739 -178.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 6.4 mm-40 -68.28 -22.9 64.71 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.354 0.597 . . . . 0.78000000000000003 110.746 177.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.633 ' N ' HD22 ' A' ' 145' ' ' ASN . 0.7 OUTLIER -99.54 -20.9 16.15 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.421 -0.808 . . . . 0.93000000000000005 110.151 -173.071 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 146.7 -33.57 1.4 Allowed Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.791 -0.719 . . . . 0.56000000000000005 112.686 175.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . 0.551 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 110.1 169.92 19.89 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.565 -0.826 . . . . 0.48999999999999999 111.844 -177.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.533 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 65.2 m95 -68.03 -34.39 76.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.731 0.265 . . . . 3.5699999999999998 111.568 -178.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -58.25 -47.1 84.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.067 0.46 . . . . 1.96 110.243 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.542 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 95.4 m -61.0 -35.37 76.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.606 -0.724 . . . . 0.67000000000000004 111.178 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.809 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 84.0 t80 -59.54 -40.96 88.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.742 0.306 . . . . 3.0 110.672 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.559 HG12 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -73.8 -24.94 20.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.322 0.582 . . . . 1.1499999999999999 110.089 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.78 -22.45 66.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.066 0.46 . . . . 1.6699999999999999 109.948 173.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 150' ' ' THR . 5.0 mt -94.33 -58.34 2.24 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.916 -0.584 . . . . 1.3 110.779 177.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -121.25 27.74 8.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.976 -0.556 . . . . 4.2400000000000002 111.591 -173.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.643 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -65.7 163.43 40.24 Favored Glycine 0 CA--C 1.497 -1.083 0 C-N-CA 120.865 -0.683 . . . . 1.1000000000000001 113.056 -178.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.525 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 24.9 t-20 . . . . . 0 C--N 1.308 -1.23 0 CA-C-N 114.205 -0.998 . . . . 1.29 110.68 178.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.937 0 N-CA-C 113.708 0.243 . . . . 1.2 113.708 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -94.07 -40.48 10.05 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 111.922 0.341 . . . . 2.8799999999999999 111.922 176.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -78.52 -48.16 15.87 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 113.119 0.785 . . . . 1.3100000000000001 113.119 -167.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.872 HD12 HG13 ' A' ' 86' ' ' VAL . 7.7 mt -75.22 -37.31 61.17 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.279 -0.637 . . . . 1.3300000000000001 109.279 -171.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 1.022 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -52.86 -49.79 65.09 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.002 -0.999 . . . . 0.88 110.169 169.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -68.28 -50.18 55.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.283 -1.326 . . . . 1.03 111.966 -176.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -73.14 -23.17 60.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.138 -0.483 . . . . 1.6699999999999999 111.478 -177.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . 0.621 ' HA2' ' CE1' ' A' ' 57' ' ' PHE . . . -74.61 -10.1 82.66 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 121.018 -0.611 . . . . 0.78000000000000003 113.01 -177.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -74.51 -20.96 59.78 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.08 0.467 . . . . 1.8999999999999999 110.898 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.453 -0.318 0 CA-C-N 116.447 -0.342 . . . . 1.4399999999999999 110.886 -175.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.08 0.467 . . . . 2.4199999999999999 110.13 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.11 -17.69 64.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.458 -0.792 . . . . 1.25 112.467 -177.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.894 ' HB3' HD13 ' A' ' 134' ' ' LEU . 21.8 m-20 -67.86 -15.76 63.77 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 120.52 -0.472 . . . . 1.78 110.005 178.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.561 HH12 ' HA ' ' A' ' 128' ' ' ALA . 12.3 tpp180 -56.83 -48.91 76.95 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.921 -0.581 . . . . 1.3999999999999999 109.747 174.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.478 ' HB3' ' CE ' ' A' ' 47' ' ' LYS . 33.9 mt-10 -53.49 -51.81 61.58 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.768 -1.105 . . . . 0.68000000000000005 111.118 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.623 HD22 ' HA ' ' A' ' 5' ' ' ASN . 1.2 mp -49.13 -35.04 15.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.864 -1.062 . . . . 1.1599999999999999 111.499 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.523 HG21 ' N ' ' A' ' 131' ' ' ALA . 72.4 t -80.63 -59.54 2.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.837 -0.62 . . . . 0.27000000000000002 110.375 175.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 6' ' ' ARG . 85.0 t -51.96 -55.64 8.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.852 -1.067 . . . . 0.33000000000000002 113.059 -176.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -54.97 -30.85 60.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.974 0.416 . . . . 0.58999999999999997 110.493 -176.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.74 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 4.0 t80 -79.18 -51.51 9.41 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.889 -0.596 . . . . 1.6100000000000001 110.546 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.952 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.0 mp -58.89 -42.95 90.77 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 121.01 -0.276 . . . . 0.34000000000000002 110.899 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.43 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 38.4 t -58.39 -40.43 82.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.283 0.563 . . . . 1.05 110.424 178.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -71.56 -23.75 61.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.795 -0.639 . . . . 1.22 110.289 -179.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.631 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.2 mmpt? -85.1 -28.78 25.36 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 116.457 -0.338 . . . . 1.4099999999999999 110.929 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.481 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -72.73 -26.33 61.54 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.066 -0.654 . . . . 1.3500000000000001 109.396 172.783 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.7 t -65.18 -33.78 76.82 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.58 -0.736 . . . . 0.93999999999999995 111.735 -178.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 16.8 pt20 -76.11 -6.04 49.35 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.367 0.603 . . . . 1.3700000000000001 111.022 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.526 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.5 mmmt -109.01 -27.78 9.46 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.961 0.886 . . . . 2.2000000000000002 108.854 -178.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.4 23.25 9.69 Favored Glycine 0 N--CA 1.441 -1.009 0 CA-C-N 113.996 -1.457 . . . . 0.53000000000000003 111.438 177.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.508 ' HD2' ' HZ ' ' A' ' 27' ' ' PHE . 84.4 m-85 -110.55 163.58 13.57 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.033 0.444 . . . . 0.76000000000000001 111.003 179.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.8 t -101.42 145.37 29.04 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.821 -0.627 . . . . 0.52000000000000002 110.176 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.43 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.5 OUTLIER -69.78 -47.46 62.82 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.044 -0.526 . . . . 3.3599999999999999 110.713 176.573 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.7 t -75.6 -23.18 56.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.417 -0.356 . . . . 1.3700000000000001 111.599 -170.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -61.39 -25.47 67.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.222 0.534 . . . . 1.1100000000000001 111.124 176.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.508 ' HZ ' ' HD2' ' A' ' 22' ' ' TYR . 6.6 m-85 -113.09 -22.21 10.66 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.979 -0.555 . . . . 1.28 111.16 -176.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.581 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 19.3 m -101.24 144.87 29.58 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 122.32 1.057 . . . . 1.8100000000000001 112.163 -178.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -118.18 -5.21 10.92 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.379 -1.737 . . . . 2.3100000000000001 109.512 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.793 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.4 m -53.57 -73.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.135 -1.393 . . . . 0.92000000000000004 113.257 -165.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.793 ' H ' HG23 ' A' ' 30' ' ' VAL . 10.4 pt-20 -96.97 2.12 51.15 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.122 -0.696 . . . . 2.7400000000000002 109.122 177.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 . . . . . 0 N--CA 1.449 -0.516 0 CA-C-N 114.761 -1.108 . . . . 1.45 110.803 179.544 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.894 HG23 ' H ' ' A' ' 42' ' ' GLU . 3.5 t . . . . . 0 CA--C 1.543 0.703 0 N-CA-C 110.543 -0.169 . . . . 1.1200000000000001 110.543 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.894 ' H ' HG23 ' A' ' 41' ' ' THR . 13.4 pt-20 -94.45 -32.19 13.64 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 122.384 1.088 . . . . 2.02 109.789 171.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.685 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 51.7 m -62.71 -24.53 67.71 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 113.206 -1.815 . . . . 1.25 114.816 -165.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -39.42 -55.52 1.75 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.517 0.511 . . . . 1.9099999999999999 112.251 -172.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.475 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -70.52 -40.07 73.72 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.796 0.295 . . . . 0.52000000000000002 111.796 179.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.631 ' HB ' ' HB3' ' A' ' 148' ' ' TRP . 2.0 m -67.74 -44.2 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 121.239 -0.185 . . . . 1.4099999999999999 111.189 -176.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.685 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.8 ptpt -69.93 -39.42 76.12 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.536 -0.542 . . . . 0.67000000000000004 109.536 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.539 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 6.0 mm100 -59.1 -33.62 71.05 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.714 -0.676 . . . . 0.98999999999999999 111.17 174.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.54 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -76.83 -39.41 51.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.39 0.614 . . . . 0.41999999999999998 110.716 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.422 HD12 ' CE2' ' A' ' 151' ' ' PHE . 1.0 OUTLIER -65.79 -25.97 67.48 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.286 -0.87 . . . . 1.3300000000000001 112.548 -174.63 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.539 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.2 ptp180 -83.34 -27.46 29.7 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.8 0.81 . . . . 2.1699999999999999 109.335 -175.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.512 ' HG2' ' HG3' ' A' ' 51' ' ' ARG . 4.3 mm-40 -80.17 -39.96 28.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.201 -1.363 . . . . 1.1000000000000001 109.715 -179.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.52 -41.57 75.85 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.581 -0.736 . . . . 0.53000000000000003 109.836 172.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.662 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.13 -31.96 74.65 Favored Glycine 0 C--O 1.222 -0.617 0 CA-C-N 115.533 -0.758 . . . . 0.69999999999999996 111.577 177.052 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -54.26 -39.16 66.6 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 122.591 0.356 . . . . 1.04 111.032 177.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.462 ' HA ' HD21 ' A' ' 59' ' ' LEU . 2.9 tt0 -79.66 -26.48 41.03 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.667 0.746 . . . . 2.29 110.574 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.412 ' CE1' ' HB2' ' A' ' 102' ' ' ALA . 10.4 m-85 -80.99 -18.41 47.0 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.084 -0.507 . . . . 2.29 112.269 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.662 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 40.1 mt-10 -66.95 -68.49 0.37 Allowed 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 120.603 0.24 . . . . 1.3 110.941 -177.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.611 HD23 ' H ' ' A' ' 59' ' ' LEU . 1.9 pt? -48.01 -38.78 17.89 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.529 -0.76 . . . . 1.54 111.242 178.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.514 ' N ' ' HG ' ' A' ' 59' ' ' LEU . 66.0 mtt180 -54.67 -53.79 50.16 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.041 -0.527 . . . . 2.5800000000000001 111.034 -177.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -85.25 -21.3 29.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.987 -0.551 . . . . 5.3200000000000003 110.678 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.783 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 43.5 ttm180 -56.16 -28.5 58.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.12 -0.491 . . . . 4.4800000000000004 110.889 179.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 63' ' ' ARG . 12.5 mmt180 -57.52 -55.6 32.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.77 -0.65 . . . . 4.7199999999999998 111.297 176.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.459 ' HB1' HD13 ' A' ' 68' ' ' LEU . . . -91.84 -32.78 15.2 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.996 0.739 . . . . 1.1699999999999999 112.996 -173.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.854 ' HA ' ' HB2' ' A' ' 68' ' ' LEU . 0.3 OUTLIER -61.07 -25.44 66.94 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.813 0.671 . . . . 2.8100000000000001 112.813 -166.566 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.4 m -63.66 -36.07 82.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.292 0.567 . . . . 2.1899999999999999 110.443 177.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -90.45 -32.41 16.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.493 -0.776 . . . . 2.7200000000000002 109.926 176.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.854 ' HB2' ' HA ' ' A' ' 65' ' ' PHE . 4.0 mp -64.67 -24.83 67.7 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 115.589 -0.732 . . . . 1.5600000000000001 112.465 -178.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.791 HG22 HG13 ' A' ' 74' ' ' ILE . 2.5 p -61.38 -26.07 67.59 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.498 -0.481 . . . . 0.69999999999999996 110.731 177.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 29.4 t -72.22 -39.35 68.59 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 109.248 -0.649 . . . . 1.3400000000000001 109.248 172.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.806 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 9.1 mt-30 -63.62 -52.53 60.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.535 -0.757 . . . . 1.4199999999999999 110.299 178.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.707 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mp -67.5 -31.33 71.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.465 -0.789 . . . . 1.3700000000000001 110.5 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 64.18 66.22 0.64 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 121.567 0.699 . . . . 2.7200000000000002 109.464 -173.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.791 HG13 HG22 ' A' ' 69' ' ' THR . 25.3 mm -62.04 117.61 3.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.648 -1.16 . . . . 0.91000000000000003 110.426 178.341 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.745 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -159.57 -172.52 0.33 Allowed Pre-proline 0 C--N 1.316 -0.881 0 N-CA-C 107.723 -1.214 . . . . 0.51000000000000001 107.723 -169.481 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.745 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 38.2 Cg_exo -29.79 166.32 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.959 3.773 . . . . 0.46999999999999997 114.996 164.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.449 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.03 -29.3 0.01 OUTLIER Glycine 0 N--CA 1.475 1.279 0 N-CA-C 117.211 1.644 . . . . 0.40000000000000002 117.211 -175.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.448 ' N ' ' O ' ' A' ' 76' ' ' PRO . 23.9 p -67.71 1.23 2.6 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.949 0.874 . . . . 0.56000000000000005 112.358 178.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.401 ' HB2' ' H ' ' A' ' 75' ' ' THR . . . -72.3 -13.93 61.62 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.101 0.476 . . . . 0.34000000000000002 110.125 171.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.441 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 53.5 t80 -75.28 -22.41 57.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.892 -0.595 . . . . 4.1299999999999999 109.581 175.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -82.7 -27.53 31.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.745 0.783 . . . . 1.03 109.608 174.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.496 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 6.5 m -69.91 -52.48 24.27 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.627 -1.17 . . . . 0.47999999999999998 109.515 172.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -66.47 -23.19 66.23 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.098 -0.955 . . . . 1.1799999999999999 110.088 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.526 ' HA ' HG23 ' A' ' 87' ' ' VAL . 30.1 tt0 -55.45 -48.7 74.08 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.159 0.504 . . . . 0.80000000000000004 110.739 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -47.12 -29.78 2.44 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.528 -1.214 . . . . 1.6200000000000001 111.748 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.673 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.0 t -90.35 -49.77 13.42 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.131 0 CA-C-N 115.121 -0.945 . . . . 1.3 110.199 -173.316 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.526 HG23 ' HA ' ' A' ' 84' ' ' GLU . 0.2 OUTLIER -52.45 -38.69 26.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 122.689 1.233 . . . . 0.84999999999999998 108.878 177.129 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.452 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 4.4 m-80 -62.65 -43.89 97.65 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 112.652 -2.067 . . . . 0.91000000000000003 112.16 -177.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 1.034 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.3 pp20? -67.71 -34.51 77.02 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 122.092 0.949 . . . . 2.8700000000000001 108.967 177.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.612 HD13 ' OE2' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -66.9 -24.9 66.16 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-N 113.135 -1.848 . . . . 1.28 111.399 -165.729 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.783 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 4.7 p90 -108.49 -35.56 6.45 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 120.329 -0.548 . . . . 2.2999999999999998 111.912 -172.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.452 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 10.3 ptm180 -75.31 -35.21 61.27 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.685 0.755 . . . . 5.0599999999999996 110.675 -171.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.428 ' HB3' HH12 ' A' ' 99' ' ' ARG . 13.6 t70 -87.59 4.27 44.38 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.827 -1.079 . . . . 3.1200000000000001 112.412 -169.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 129.67 70.13 0.12 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 117.375 -2.345 . . . . 2.3100000000000001 115.505 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.783 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 64.5 t -69.94 99.22 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-O 122.613 1.197 . . . . 1.0600000000000001 110.93 -179.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.733 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 0.2 OUTLIER -107.45 -179.03 3.8 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 113.402 -1.726 . . . . 2.1200000000000001 107.726 168.033 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.61 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 15.2 m-90 -49.7 -40.87 41.83 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 123.36 0.412 . . . . 3.3399999999999999 111.569 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -64.76 -41.01 97.8 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 114.574 0.59 . . . . 0.68999999999999995 114.574 -175.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.733 ' HG2' ' ND2' ' A' ' 96' ' ' ASN . 13.9 mmt85 -58.79 -43.27 90.42 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.21 0.529 . . . . 4.2400000000000002 111.123 -175.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 70.3 mt -68.89 -41.0 81.87 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.533 -0.758 . . . . 0.44 110.622 -176.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 97' ' ' TRP . 63.0 t -54.45 -54.58 20.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.024 -0.535 . . . . 1.3500000000000001 109.856 171.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.412 ' HB2' ' CE1' ' A' ' 57' ' ' PHE . . . -52.33 -45.78 65.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.015 -0.993 . . . . 0.44 111.384 177.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.618 ' HZ ' ' HA ' ' A' ' 130' ' ' MET . 42.5 t80 -55.21 -39.63 69.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.749 . . . . 1.49 111.25 178.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 1.004 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 27.0 m-85 -78.47 -35.69 46.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.683 0.278 . . . . 3.29 111.116 177.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.74 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 23.1 m -63.69 -47.47 81.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.241 -0.436 . . . . 1.1899999999999999 110.658 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.437 ' HE1' ' HB2' ' A' ' 65' ' ' PHE . 50.1 t80 -81.74 -29.29 32.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.022 -0.536 . . . . 2.8900000000000001 110.618 -178.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.46 -47.72 61.3 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.769 -0.729 . . . . 0.29999999999999999 111.285 175.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.952 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -64.92 -28.59 73.66 Favored Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 111.466 -0.654 . . . . 0.23000000000000001 111.466 176.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.1 -32.75 61.51 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.295 -0.261 . . . . 0.31 110.295 176.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.402 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -68.29 -36.25 79.08 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-O 121.896 0.855 . . . . 1.1200000000000001 109.494 -179.01 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.702 ' SG ' HG13 ' A' ' 123' ' ' VAL . 24.5 t -49.34 -50.88 37.8 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 113.77 -1.559 . . . . 0.26000000000000001 109.579 171.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.526 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 96.4 t -67.27 -34.43 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 115.634 -0.712 . . . . 0.34999999999999998 110.945 177.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.624 ' HB3' HG21 ' A' ' 74' ' ' ILE . 7.8 mm-40 -59.87 -28.98 68.0 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.388 0.614 . . . . 2.5099999999999998 110.5 177.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.511 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 18.3 m -78.89 -39.61 34.53 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.347 -0.842 . . . . 0.28000000000000003 109.082 177.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.648 HG23 ' O ' ' A' ' 111' ' ' CYS . 96.4 t -67.37 -34.66 70.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.985 0.898 . . . . 1.23 109.634 -177.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -54.78 -50.79 67.62 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.584 -1.644 . . . . 0.59999999999999998 111.25 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 24.6 mmtt -86.33 12.75 9.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.717 -0.674 . . . . 1.6200000000000001 110.055 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.39 52.07 4.98 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.87 0.843 . . . . 1.8799999999999999 110.971 -178.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.558 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 25.9 mtm -125.74 44.52 2.81 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.394 -1.276 . . . . 0.31 107.883 178.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.46 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 5.8 mt-30 -60.02 -8.13 2.17 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.763 1.023 . . . . 1.1499999999999999 113.763 -173.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.505 HG23 HD22 ' A' ' 122' ' ' LEU . 27.1 m -66.81 -24.5 32.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 O-C-N 122.008 -0.432 . . . . 0.46000000000000002 110.904 175.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.789 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -71.3 -26.85 63.04 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 116.434 -0.348 . . . . 0.26000000000000001 110.338 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.702 HG13 ' SG ' ' A' ' 111' ' ' CYS . 69.1 t -46.86 -54.64 2.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 123.576 0.548 . . . . 0.25 111.64 178.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.581 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 2.5 t -70.79 -29.57 65.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.738 0.304 . . . . 1.3500000000000001 110.757 -179.161 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.789 ' HD2' HD13 ' A' ' 122' ' ' LEU . 73.8 mtt180 -69.31 -54.37 14.93 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.029 0.442 . . . . 2.6699999999999999 110.436 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.595 HG22 ' SD ' ' A' ' 130' ' ' MET . 73.0 mt -56.01 -52.02 54.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.618 -0.719 . . . . 0.23000000000000001 110.451 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.816 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.02 -33.73 69.27 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 120.889 0.376 . . . . 0.28999999999999998 111.599 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.561 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -62.21 -62.31 1.86 Allowed 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 121.124 0.488 . . . . 0.28000000000000003 110.379 176.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -62.07 -32.95 73.54 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.05 -0.977 . . . . 3.9100000000000001 111.617 -175.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.618 ' HA ' ' HZ ' ' A' ' 103' ' ' PHE . 88.9 mtp -61.63 -53.57 54.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.981 0.419 . . . . 1.0800000000000001 110.837 178.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.523 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -63.82 -39.07 93.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.046 -0.524 . . . . 0.25 110.982 179.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 86.3 m -63.66 -47.49 81.06 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.454 -0.339 . . . . 0.40000000000000002 111.074 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.425 ' CE2' HG12 ' A' ' 87' ' ' VAL . 52.2 t80 -57.21 -39.69 75.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.506 -0.315 . . . . 3.1299999999999999 110.403 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 1.004 HD12 ' HZ ' ' A' ' 104' ' ' PHE . 4.8 tt -58.32 -54.26 49.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.365 -0.976 . . . . 0.94999999999999996 108.365 172.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -52.73 -46.31 67.35 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.229 -0.896 . . . . 0.46000000000000002 112.194 -177.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -80.13 -59.19 2.81 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.319 0.58 . . . . 0.58999999999999997 111.509 -176.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -92.62 -47.44 7.1 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 113.354 0.872 . . . . 1.45 113.354 -168.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.968 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -80.25 -43.35 21.52 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 113.502 0.927 . . . . 1.2 113.502 -166.636 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.665 ' HA ' HD12 ' A' ' 142' ' ' ILE . 32.9 tt0 -45.27 -53.11 18.65 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 112.919 0.711 . . . . 0.75 112.919 -175.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.54 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 19.6 Cg_endo -58.62 -45.29 30.66 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.693 1.595 . . . . 0.56000000000000005 111.718 178.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -61.5 -42.58 99.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.419 -0.809 . . . . 1.2 110.547 178.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.665 HD12 ' HA ' ' A' ' 139' ' ' GLU . 28.1 mt -52.11 -49.16 40.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.876 -0.602 . . . . 0.32000000000000001 110.83 174.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.621 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 71.1 mm-40 -63.06 -25.86 68.57 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.547 -0.751 . . . . 0.56999999999999995 111.324 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.54 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.6 mm-40 -68.15 -22.27 64.86 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.447 0.641 . . . . 0.78000000000000003 110.0 174.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.607 ' N ' HD22 ' A' ' 145' ' ' ASN . 0.7 OUTLIER -105.03 4.08 31.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.149 -0.932 . . . . 0.93000000000000005 109.785 -174.906 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 111.41 -43.28 1.75 Allowed Glycine 0 N--CA 1.442 -0.935 0 CA-C-N 115.385 -0.825 . . . . 0.56000000000000005 112.437 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . 0.58 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 128.6 -176.88 18.08 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.368 -0.92 . . . . 0.48999999999999999 112.808 178.284 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.631 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 8.5 m-90 -70.76 -38.48 73.46 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 122.683 0.393 . . . . 3.5699999999999998 110.843 -178.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -61.35 -45.05 96.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.938 0.399 . . . . 1.96 110.197 178.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.545 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 93.4 m -59.13 -35.41 73.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.853 -0.612 . . . . 0.67000000000000004 111.477 178.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.61 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 88.4 t80 -60.96 -42.01 97.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.802 0.335 . . . . 3.0 110.509 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.475 HG21 ' HB1' ' A' ' 45' ' ' ALA . 1.6 m -71.59 -25.09 24.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 1.1499999999999999 110.27 179.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.487 ' HB2' ' O ' ' A' ' 150' ' ' THR . 19.2 mm-40 -62.19 -30.36 71.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.88 0.371 . . . . 1.6699999999999999 110.33 171.409 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.7 mt -90.52 -62.05 1.54 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.135 -0.484 . . . . 1.3 110.941 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -123.64 29.65 6.5 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.451 0.643 . . . . 4.2400000000000002 110.721 -175.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.54 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -58.16 165.81 7.03 Favored Glycine 0 CA--C 1.499 -0.917 0 CA-C-N 115.474 -0.785 . . . . 1.1000000000000001 113.759 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.486 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 27.4 t-20 . . . . . 0 C--N 1.307 -1.26 0 CA-C-N 113.888 -1.156 . . . . 1.29 110.837 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . 0.939 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.526 0.721 0 CA-C-O 120.99 0.216 . . . . 1.2 113.293 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . 0.833 ' HD3' ' H ' ' B' 1007 ' ' ALA . 0.0 OUTLIER -145.79 -29.56 0.42 Allowed 'General case' 0 C--O 1.215 -0.746 0 C-N-CA 122.787 0.435 . . . . 2.8799999999999999 110.344 175.888 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . 0.833 ' H ' ' HD3' ' B' 1006 ' ' ARG . . . -120.33 -27.3 5.26 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-N 115.984 -0.553 . . . . 1.3100000000000001 110.708 -176.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.422 ' HG ' HG13 ' A' ' 86' ' ' VAL . 2.7 mm? -61.02 -46.77 89.39 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 106.069 -1.826 . . . . 1.3300000000000001 106.069 165.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 1.034 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -53.97 -56.9 13.53 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 113.629 -1.623 . . . . 0.88 111.832 167.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . 0.775 ' HB3' ' HA ' ' B' 1007 ' ' ALA . . . -67.44 -54.33 21.2 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.165 -0.925 . . . . 1.03 112.908 -171.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 5.7 m-30 -66.0 -26.69 67.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.311 -0.404 . . . . 1.6699999999999999 110.131 -176.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -87.5 1.01 85.64 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.662 -0.699 . . . . 0.78000000000000003 113.458 -176.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 4.1 t70 -89.48 -3.21 58.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.162 0.506 . . . . 1.8999999999999999 110.246 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 3.2 m . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 115.949 -0.568 . . . . 1.4399999999999999 110.357 -179.488 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.1 mp0 . . . . . 0 CA--C 1.522 -0.125 0 CA-C-O 121.349 0.595 . . . . 2.4199999999999999 109.601 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.518 ' O ' HD13 ' A' ' 8' ' ' LEU . 1.5 p -68.66 -22.71 64.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.509 -0.769 . . . . 1.25 111.554 -178.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.517 ' HB3' HD22 ' A' ' 134' ' ' LEU . 3.1 p30 -62.72 -24.17 67.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.103 -0.499 . . . . 1.78 110.404 175.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.534 ' O ' HG23 ' A' ' 10' ' ' VAL . 3.9 tpp180 -61.53 -44.64 96.69 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.766 -0.652 . . . . 1.3999999999999999 109.832 174.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.435 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 42.6 mt-10 -56.1 -57.85 10.4 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 115.554 -0.748 . . . . 0.68000000000000005 110.166 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.518 HD13 ' O ' ' A' ' 4' ' ' SER . 5.8 mp -41.53 -50.25 4.01 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.647 -1.161 . . . . 1.1599999999999999 111.098 178.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.472 HG21 ' N ' ' A' ' 131' ' ' ALA . 79.0 t -64.66 -59.5 4.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.51 -0.313 . . . . 0.27000000000000002 111.04 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 6' ' ' ARG . 85.4 t -54.13 -48.14 65.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.135 -0.484 . . . . 0.33000000000000002 112.122 -175.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -51.09 -43.83 61.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.93 -0.577 . . . . 0.58999999999999997 110.808 -177.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.642 ' HB2' ' CE2' ' A' ' 104' ' ' PHE . 6.1 t80 -81.59 -41.34 21.69 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.19 -0.459 . . . . 1.6100000000000001 111.679 -175.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 1.028 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 3.8 mp -60.46 -40.21 90.39 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 119.771 -0.772 . . . . 0.34000000000000002 109.745 178.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.495 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 48.5 t -64.07 -46.5 84.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.673 -0.694 . . . . 1.05 110.067 175.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -60.36 -32.22 71.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.518 -0.764 . . . . 1.22 110.9 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.704 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 6.4 mmpt? -75.61 -33.19 60.51 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 111.839 0.311 . . . . 1.4099999999999999 111.839 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.606 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -62.22 -27.72 69.19 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.736 -0.786 . . . . 1.3500000000000001 109.788 175.163 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.9 t -65.61 -30.33 71.04 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.379 -0.828 . . . . 0.93999999999999995 112.219 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.704 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 13.4 pt20 -74.92 -9.24 58.36 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.773 0.657 . . . . 1.3700000000000001 112.773 -172.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.785 ' NZ ' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -119.24 -19.94 8.14 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 121.918 0.866 . . . . 2.2000000000000002 109.549 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.51 26.4 6.89 Favored Glycine 0 C--N 1.306 -1.086 0 CA-C-N 113.945 -1.48 . . . . 0.53000000000000003 113.058 173.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -104.98 171.23 7.43 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.612 0.244 . . . . 0.76000000000000001 110.555 170.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.6 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 8.3 t -110.67 157.63 19.51 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.104 0.478 . . . . 0.52000000000000002 110.861 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.534 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 65.6 t-105 -75.92 -52.05 11.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.516 -0.766 . . . . 3.3599999999999999 110.172 174.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m -67.21 -19.91 65.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.579 -0.737 . . . . 1.3700000000000001 111.685 -174.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.6 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 51.3 mt-30 -51.93 -38.7 57.36 Favored 'General case' 0 N--CA 1.461 0.092 0 N-CA-C 111.793 0.294 . . . . 1.1100000000000001 111.793 177.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -121.93 -4.15 9.11 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.831 0.678 . . . . 1.28 112.831 -178.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.638 ' HB3' HG22 ' A' ' 30' ' ' VAL . 19.8 m -102.16 149.23 24.49 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 122.026 0.917 . . . . 1.8100000000000001 112.094 -178.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -124.37 -1.71 8.09 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 113.594 -1.639 . . . . 2.3100000000000001 109.015 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.863 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.6 m -58.75 -73.7 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 113.889 -1.505 . . . . 0.92000000000000004 112.801 -168.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.863 ' H ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -90.73 0.06 57.54 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.481 0.658 . . . . 2.7400000000000002 109.868 177.262 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 . . . . . 0 N--CA 1.447 -0.586 0 CA-C-N 114.774 -1.103 . . . . 1.45 110.857 179.339 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.699 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.308 0 N-CA-C 110.28 -0.267 . . . . 1.1200000000000001 110.28 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.699 ' H ' HG23 ' A' ' 41' ' ' THR . 14.3 pt-20 -93.85 -31.24 14.42 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.011 0.91 . . . . 2.02 109.892 173.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.747 ' HA ' HG13 ' A' ' 46' ' ' VAL . 57.7 m -63.66 -25.11 68.07 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 113.653 -1.612 . . . . 1.25 113.261 -170.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -40.12 -50.8 2.65 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 123.613 0.571 . . . . 1.9099999999999999 112.314 -173.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.82 -40.05 41.75 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.931 -0.308 . . . . 0.52000000000000002 111.652 176.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.747 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.9 m -65.12 -46.13 92.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 121.284 -0.166 . . . . 1.4099999999999999 111.381 -176.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.744 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.8 ptpt -68.34 -40.27 81.64 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.457 -0.571 . . . . 0.67000000000000004 109.457 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.7 HE21 ' HA ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -58.34 -38.4 77.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.414 -0.812 . . . . 0.98999999999999999 111.086 174.882 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.5 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -72.06 -41.57 67.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.4 0.619 . . . . 0.41999999999999998 110.981 176.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.546 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.1 tp -65.98 -24.83 66.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.318 -0.856 . . . . 1.3300000000000001 112.087 -174.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.616 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 7.6 ptp180 -85.63 -25.91 26.34 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 121.705 0.764 . . . . 2.1699999999999999 109.491 -177.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.821 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 7.5 mm-40 -69.57 -47.54 63.26 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.705 -1.134 . . . . 1.1000000000000001 109.282 173.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' A' ' 56' ' ' GLU . . . -66.81 -33.19 75.07 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.084 -0.962 . . . . 0.53000000000000003 110.173 174.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.655 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -59.06 -46.44 93.74 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.371 -0.692 . . . . 0.69999999999999996 111.371 176.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.652 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 30.4 t70 -63.26 -37.29 86.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.963 0.411 . . . . 1.04 110.283 176.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.485 ' O ' HD11 ' A' ' 59' ' ' LEU . 14.6 tp10 -60.48 -28.15 68.12 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.34 -0.845 . . . . 2.29 110.469 176.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.693 ' HZ ' ' HB3' ' B' 1008 ' ' LEU . 49.8 t80 -81.9 -46.56 13.9 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.322 -0.854 . . . . 2.29 110.771 174.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.747 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 46.3 mt-10 -60.13 -57.67 11.8 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.504 -0.771 . . . . 1.3 112.76 -170.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.705 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -43.32 -41.47 4.06 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.853 1.057 . . . . 1.54 113.853 -172.851 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.705 ' H ' HD12 ' A' ' 59' ' ' LEU . 72.5 mtt85 -67.81 -45.71 73.96 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.011 0.374 . . . . 2.5800000000000001 112.011 -175.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.747 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 5.0 p90 -92.42 -3.87 54.59 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.731 -0.213 . . . . 5.3200000000000003 111.159 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.9 tpp180 -43.36 -49.52 6.94 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.361 0.664 . . . . 4.4800000000000004 112.578 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -67.21 -13.51 62.03 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.209 0.448 . . . . 4.7199999999999998 112.209 -175.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.487 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -92.14 -26.6 18.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.842 0.312 . . . . 1.1699999999999999 111.842 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.613 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 81.3 t80 -48.96 -46.45 43.48 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.078 0.77 . . . . 2.8100000000000001 113.078 -170.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.8 t -68.03 -40.14 82.96 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.913 0.387 . . . . 2.1899999999999999 110.896 -175.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -71.2 -39.45 71.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.049 -0.523 . . . . 2.7200000000000002 111.006 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.487 HD13 ' O ' ' A' ' 64' ' ' ALA . 3.7 mp -64.81 -20.46 66.4 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 113.211 0.819 . . . . 1.5600000000000001 113.211 -171.121 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.528 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 3.2 p -57.45 -35.49 70.19 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.064 0.847 . . . . 0.69999999999999996 111.16 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.0 t -71.93 -25.36 61.86 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.54 -0.754 . . . . 1.3400000000000001 109.528 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.48 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 9.2 mt-30 -83.82 -38.01 21.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.223 -0.898 . . . . 1.4199999999999999 110.133 -178.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.583 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.8 mm? -65.96 -32.99 74.8 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.734 -0.469 . . . . 1.3700000000000001 109.734 170.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.433 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 50.6 m80 68.16 41.77 1.89 Allowed 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.144 -1.058 . . . . 2.7200000000000002 108.144 -173.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.583 HG12 ' HB2' ' A' ' 72' ' ' LEU . 28.0 mm -50.44 117.15 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 113.322 -1.763 . . . . 0.91000000000000003 111.931 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.761 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.46 -171.48 0.28 Allowed Pre-proline 0 N--CA 1.441 -0.913 0 N-CA-C 107.43 -1.322 . . . . 0.51000000000000001 107.43 -173.097 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.761 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.7 Cg_exo -28.86 166.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 125.017 3.811 . . . . 0.46999999999999997 115.355 164.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.527 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -29.09 -28.75 0.01 OUTLIER Glycine 0 N--CA 1.472 1.074 0 N-CA-C 117.937 1.935 . . . . 0.40000000000000002 117.937 -170.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.471 ' N ' ' O ' ' A' ' 76' ' ' PRO . 41.7 p -66.72 5.8 0.57 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 118.31 1.055 . . . . 0.56000000000000005 112.339 -178.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.9 -12.43 61.61 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.975 0.417 . . . . 0.34000000000000002 110.096 174.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.527 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 10.4 p90 -76.33 -17.3 59.49 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.427 0.632 . . . . 4.1299999999999999 109.349 174.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.436 ' HB2' ' O ' ' A' ' 78' ' ' THR . 35.7 mt-30 -84.91 -20.02 31.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.101 -0.954 . . . . 1.03 109.698 174.015 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.0 m -82.04 -53.28 6.25 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.531 -1.213 . . . . 0.47999999999999998 109.667 173.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.551 ' HA ' HG23 ' A' ' 86' ' ' VAL . 78.3 t80 -63.09 -16.68 60.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.326 -0.852 . . . . 1.1799999999999999 110.111 174.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.526 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.3 tt0 -54.68 -50.23 68.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.205 -0.907 . . . . 0.80000000000000004 110.374 173.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -49.94 -32.15 14.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.986 -1.006 . . . . 1.6200000000000001 110.888 177.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.883 HG13 HD12 ' B' 1008 ' ' LEU . 1.8 t -80.93 -53.49 12.31 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-N 114.733 -1.121 . . . . 1.3 110.443 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.526 HG12 ' HA ' ' A' ' 84' ' ' GLU . 8.9 p -60.98 -23.55 30.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.815 0.817 . . . . 0.84999999999999998 109.337 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.6 m-80 -78.06 -38.87 43.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.338 -1.301 . . . . 0.91000000000000003 112.089 176.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 1.114 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.0 OUTLIER -73.84 -32.38 63.65 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.343 -0.984 . . . . 2.8700000000000001 108.343 178.805 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.676 HD13 ' OE1' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -67.61 -44.02 79.06 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.553 -1.203 . . . . 1.28 110.233 -174.059 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.407 ' CD1' ' HA ' ' A' ' 88' ' ' ASN . 0.4 OUTLIER -99.14 10.18 41.96 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.496 -0.774 . . . . 2.2999999999999998 111.066 -169.802 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.862 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.09 -23.47 66.54 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.108 -0.496 . . . . 5.0599999999999996 110.542 178.301 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -96.44 -31.11 12.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 122.068 0.937 . . . . 3.1200000000000001 109.186 169.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.59 ' O ' HG23 ' A' ' 95' ' ' VAL . . . 130.79 -42.1 1.44 Allowed Glycine 0 C--N 1.312 -0.79 0 CA-C-N 113.862 -1.517 . . . . 2.3100000000000001 113.234 165.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.649 HG21 HD22 ' A' ' 138' ' ' LEU . 1.6 t 168.2 131.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 C-N-CA 125.079 1.352 . . . . 1.0600000000000001 110.582 157.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.643 ' H ' ' CB ' ' A' ' 99' ' ' ARG . 2.0 m120 -111.16 170.07 8.35 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.387 -0.824 . . . . 2.1200000000000001 109.313 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.554 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 16.9 m-90 -54.76 -58.05 9.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.933 0.396 . . . . 3.3399999999999999 110.713 175.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.435 ' O ' HG13 ' A' ' 101' ' ' VAL . . . -70.2 -13.94 70.79 Favored Glycine 0 CA--C 1.518 0.272 0 CA-C-N 115.93 -0.577 . . . . 0.68999999999999995 112.689 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.643 ' CB ' ' H ' ' A' ' 96' ' ' ASN . 18.2 tpp180 -69.35 -43.2 74.1 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.078 0.466 . . . . 4.2400000000000002 110.97 -176.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 90.2 mt -64.67 -40.26 88.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.731 -0.668 . . . . 0.44 110.547 -178.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.551 ' O ' ' HD1' ' A' ' 104' ' ' PHE . 0.5 OUTLIER -63.97 -38.19 81.76 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 CA-C-N 116.204 -0.453 . . . . 1.3500000000000001 110.322 175.592 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.1 -46.44 89.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.354 0.597 . . . . 0.44 110.217 176.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -58.22 -50.0 75.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.81 -1.087 . . . . 1.49 111.284 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.642 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -76.49 -20.04 57.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.808 0.337 . . . . 3.29 110.948 -176.32 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.617 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 37.3 t -75.67 -55.98 5.13 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.261 -0.427 . . . . 1.1899999999999999 110.304 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.431 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 31.4 t80 -66.49 -26.66 67.28 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 109.448 -0.575 . . . . 2.8900000000000001 109.448 179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.57 ' HA3' ' HE1' ' A' ' 130' ' ' MET . . . -65.11 -38.53 95.42 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 121.09 -0.576 . . . . 0.29999999999999999 111.735 174.036 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 1.028 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -68.77 -35.4 79.93 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.587 -0.816 . . . . 0.23000000000000001 111.076 174.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.613 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -67.81 -33.3 74.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.366 -0.417 . . . . 0.31 110.627 176.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.447 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -60.93 -37.42 82.25 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 122.221 1.01 . . . . 1.1200000000000001 108.708 -178.854 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.66 ' HB2' HD23 ' A' ' 13' ' ' LEU . 35.3 t -58.69 -53.74 54.98 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.038 -1.437 . . . . 0.26000000000000001 110.148 174.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.785 HG13 ' NZ ' ' A' ' 20' ' ' LYS . 80.7 t -60.18 -40.79 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 116.619 -0.264 . . . . 0.34999999999999998 110.914 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.528 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 35.6 mt-10 -54.45 -38.22 66.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.011 0.434 . . . . 2.5099999999999998 110.611 176.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 48.0 m -74.38 -38.78 63.06 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.491 0.663 . . . . 0.28000000000000003 109.543 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.646 ' HA ' ' HG2' ' A' ' 120' ' ' GLN . 92.0 t -69.31 -30.31 45.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.114 -0.948 . . . . 1.23 109.783 -177.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.81 -49.79 74.32 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 113.641 -1.618 . . . . 0.59999999999999998 111.027 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 25.8 mmtt -87.4 11.96 13.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.439 -0.801 . . . . 1.6200000000000001 110.278 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 61.32 50.9 4.49 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 122.044 0.926 . . . . 1.8799999999999999 110.556 -178.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.608 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 24.3 mtm -125.63 46.91 2.3 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.255 -1.339 . . . . 0.31 107.565 176.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.646 ' HG2' ' HA ' ' A' ' 115' ' ' VAL . 27.8 mt-30 -68.44 -5.79 21.19 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.083 -0.962 . . . . 1.1499999999999999 111.142 -172.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.636 HG23 HD22 ' A' ' 122' ' ' LEU . 25.8 m -58.02 -24.65 24.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 122.142 -0.349 . . . . 0.46000000000000002 110.895 172.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.704 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.0 mm? -76.06 -26.8 56.9 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.481 -0.327 . . . . 0.26000000000000001 110.391 178.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.615 HG22 ' SG ' ' A' ' 111' ' ' CYS . 78.8 t -45.63 -57.62 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 O-C-N 123.806 0.691 . . . . 0.25 111.707 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -21.45 57.62 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.787 -0.642 . . . . 1.3500000000000001 111.639 -176.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.704 ' HD2' HD13 ' A' ' 122' ' ' LEU . 86.7 mtt180 -72.35 -58.22 3.57 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.924 -0.58 . . . . 2.6699999999999999 110.385 175.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.636 ' HA ' ' CE2' ' A' ' 129' ' ' TRP . 86.9 mt -48.25 -49.41 12.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.426 -0.806 . . . . 0.23000000000000001 111.595 -176.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.534 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -59.64 -26.3 65.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.09 0.404 . . . . 0.28999999999999998 112.09 -177.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.18 -65.13 0.71 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.496 0.665 . . . . 0.28000000000000003 110.046 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.636 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 38.7 p-90 -75.16 -17.85 60.31 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.04 -0.982 . . . . 3.9100000000000001 111.747 -175.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.57 ' HE1' ' HA3' ' A' ' 107' ' ' GLY . 13.3 mmm -62.21 -57.67 10.59 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 120.967 0.413 . . . . 1.0800000000000001 110.248 170.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.472 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -64.0 -38.29 90.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.883 -0.598 . . . . 0.25 110.538 179.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.516 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 89.1 m -60.78 -43.56 97.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.399 -0.364 . . . . 0.40000000000000002 111.534 176.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -60.88 -39.9 90.99 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.775 -0.454 . . . . 3.1299999999999999 109.775 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.517 HD22 ' HB3' ' A' ' 5' ' ' ASN . 5.4 tt -62.18 -50.87 70.1 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.603 -0.888 . . . . 0.94999999999999996 108.603 173.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -48.69 -56.74 7.69 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.977 -0.556 . . . . 0.46000000000000002 112.41 179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -78.06 -49.74 13.4 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.043 0.449 . . . . 0.58999999999999997 111.88 -174.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -91.3 -50.81 5.61 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 112.788 0.662 . . . . 1.45 112.788 -169.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.649 HD22 HG21 ' A' ' 95' ' ' VAL . 53.7 mt -86.29 -34.68 20.28 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 112.729 0.64 . . . . 1.2 112.729 -166.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.627 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 21.0 tt0 -49.84 -51.39 61.09 Favored Pre-proline 0 CA--C 1.539 0.545 0 O-C-N 123.198 0.311 . . . . 0.75 111.707 -174.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.589 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 24.6 Cg_exo -63.42 -43.3 18.32 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 121.934 1.756 . . . . 0.56000000000000005 111.951 176.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 5.6 t-105 -59.45 -47.35 85.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.418 -0.81 . . . . 1.2 110.223 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.579 HG22 ' HA2' ' A' ' 147' ' ' GLY . 37.4 mt -48.39 -51.58 10.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.592 -0.731 . . . . 0.32000000000000001 111.095 174.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.627 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 70.1 mm-40 -57.15 -35.25 69.29 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.718 -0.673 . . . . 0.56999999999999995 111.303 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 9.5 mm-40 -64.8 -21.54 66.8 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.437 0.637 . . . . 0.78000000000000003 111.307 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.41 ' HB3' ' NE1' ' A' ' 97' ' ' TRP . 16.2 m-80 -110.65 9.21 22.91 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.256 -0.884 . . . . 0.93000000000000005 110.105 -174.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 116.43 -47.52 1.03 Allowed Glycine 0 N--CA 1.441 -1.029 0 CA-C-N 114.78 -1.1 . . . . 0.56000000000000005 112.704 174.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . 0.579 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 132.01 -177.24 18.82 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.761 -0.733 . . . . 0.48999999999999999 111.961 -177.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.608 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 13.6 m-90 -71.01 -37.95 72.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.019 0.438 . . . . 3.5699999999999998 110.258 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.605 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 6.2 m-20 -64.07 -31.49 72.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.638 -0.71 . . . . 1.96 110.339 178.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.593 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 87.0 m -67.34 -40.04 85.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.068 -0.515 . . . . 0.67000000000000004 111.508 179.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.554 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 85.3 t80 -64.72 -31.06 72.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.797 0.808 . . . . 3.0 109.104 -178.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.605 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 87.4 t -59.67 -50.24 80.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 114.422 -1.263 . . . . 1.1499999999999999 110.35 172.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.79 -28.45 64.01 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.829 -1.078 . . . . 1.6699999999999999 111.518 176.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 150' ' ' THR . 10.2 mt -86.37 -56.13 3.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.458 -0.337 . . . . 1.3 111.26 -177.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -115.11 -44.25 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.871 -0.332 . . . . 4.2400000000000002 110.461 -178.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.5 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . 50.86 -160.17 1.61 Allowed Glycine 0 CA--C 1.509 -0.343 0 CA-C-O 121.813 0.674 . . . . 1.1000000000000001 114.597 178.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.821 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 23.9 t-20 . . . . . 0 N--CA 1.433 -1.289 0 CA-C-N 114.37 -0.915 . . . . 1.29 110.197 -177.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . 0.401 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.53 0.998 0 N-CA-C 114.026 0.371 . . . . 1.2 114.026 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . 0.448 ' HA ' ' HD3' ' B' 1006 ' ' ARG . 26.2 mmt180 -102.63 -48.5 4.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.951 0.405 . . . . 2.8799999999999999 111.125 174.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -63.23 -53.88 46.06 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.913 0.709 . . . . 1.3100000000000001 112.913 -169.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.883 HD12 HG13 ' A' ' 86' ' ' VAL . 3.1 mt -72.55 -40.41 66.72 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.335 -0.617 . . . . 1.3300000000000001 109.335 -171.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 1.114 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -47.73 -49.97 26.63 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 122.212 1.006 . . . . 0.88 109.92 169.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -69.14 -49.42 57.09 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 113.82 -1.537 . . . . 1.03 111.997 -175.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 28.7 m-85 -68.4 -23.76 64.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.238 -0.437 . . . . 1.6699999999999999 111.161 -176.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -68.18 -23.81 74.72 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 116.062 -0.517 . . . . 0.78000000000000003 113.639 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.62 -2.87 12.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.274 0.472 . . . . 1.8999999999999999 112.274 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 32.8 m . . . . . 0 C--N 1.327 -0.406 0 N-CA-C 111.901 0.334 . . . . 1.4399999999999999 111.901 -178.728 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 . . . . . 0 C--O 1.232 0.181 0 CA-C-O 121.579 0.704 . . . . 2.4199999999999999 109.707 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.434 ' HB3' ' OG ' ' A' ' 43' ' ' SER . 1.4 m -64.64 -26.47 68.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.071 -0.968 . . . . 1.25 112.208 -174.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.619 ' HB2' HD13 ' A' ' 134' ' ' LEU . 5.2 p30 -66.39 -28.56 68.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.674 0.274 . . . . 1.78 111.483 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.588 ' O ' HG23 ' A' ' 10' ' ' VAL . 7.2 tpp180 -56.99 -46.14 82.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.021 -0.536 . . . . 1.3999999999999999 110.113 177.478 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.498 ' OE1' ' HB2' ' A' ' 43' ' ' SER . 44.1 mt-10 -55.18 -49.71 71.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.123 -0.944 . . . . 0.68000000000000005 111.367 -178.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.519 HD21 ' CB ' ' A' ' 43' ' ' SER . 9.0 mt -58.7 -35.83 73.27 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.936 -1.029 . . . . 1.1599999999999999 110.271 -173.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.481 HG11 ' O ' ' A' ' 127' ' ' ALA . 75.8 t -70.97 -58.94 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.558 -0.747 . . . . 0.27000000000000002 109.985 174.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 6' ' ' ARG . 86.5 t -52.88 -55.62 11.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.864 -1.062 . . . . 0.33000000000000002 112.243 -174.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.42 -36.35 71.24 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.142 -0.481 . . . . 0.58999999999999997 110.385 -177.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.689 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 5.7 t80 -70.45 -49.38 49.24 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.847 -0.615 . . . . 1.6100000000000001 110.573 -178.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.993 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.0 mp -62.11 -38.64 89.66 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 120.558 -0.457 . . . . 0.34000000000000002 110.489 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.433 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 28.6 t -55.65 -46.34 77.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.883 -0.599 . . . . 1.05 110.403 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.411 ' HD2' ' HZ1' ' A' ' 16' ' ' LYS . 38.6 t80 -69.04 -29.07 67.14 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.896 -0.593 . . . . 1.22 110.85 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.636 ' HG2' ' O ' ' A' ' 12' ' ' PHE . 10.0 mmpt? -71.71 -37.42 70.66 Favored 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 121.057 -0.257 . . . . 1.4099999999999999 110.709 -179.06 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.487 HD21 ' SG ' ' A' ' 111' ' ' CYS . 0.2 OUTLIER -66.64 -30.73 71.06 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.943 -0.391 . . . . 1.3500000000000001 109.943 174.761 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.0 t -64.05 -25.55 68.16 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.978 -0.556 . . . . 0.93999999999999995 111.451 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -72.68 -18.53 61.54 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.863 0.84 . . . . 1.3700000000000001 110.095 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.54 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 19.0 mmmt -104.83 -26.36 12.26 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.249 -1.341 . . . . 2.2000000000000002 109.281 -175.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.35 26.53 7.7 Favored Glycine 0 N--CA 1.438 -1.193 0 CA-C-N 113.815 -1.539 . . . . 0.53000000000000003 111.433 178.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.666 ' HB3' ' HE2' ' A' ' 27' ' ' PHE . 96.0 m-85 -115.46 166.82 11.46 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.335 -0.432 . . . . 0.76000000000000001 110.298 177.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.9 t -110.8 145.76 37.59 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.274 -0.421 . . . . 0.52000000000000002 110.632 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 1.7 t90 -68.88 -49.99 53.52 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.248 -0.433 . . . . 3.3599999999999999 109.897 174.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.8 p -61.77 -37.46 84.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.642 -0.708 . . . . 1.3700000000000001 111.45 -173.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -58.88 -28.75 66.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.209 -0.451 . . . . 1.1100000000000001 111.477 178.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.666 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 17.4 m-85 -117.04 16.31 15.04 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.035 0.445 . . . . 1.28 110.726 -175.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.61 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 78.9 p -100.46 179.52 4.42 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.4 0.619 . . . . 1.8100000000000001 111.814 -174.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.611 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 14.3 t70 -167.05 -13.17 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.399 -1.273 . . . . 2.3100000000000001 108.515 -178.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.931 HG23 ' H ' ' A' ' 31' ' ' GLU . 9.0 m -67.48 -72.0 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.232 -1.349 . . . . 0.92000000000000004 111.707 179.085 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.931 ' H ' HG23 ' A' ' 30' ' ' VAL . 28.4 mm-40 -94.48 2.54 55.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.846 -0.798 . . . . 2.7400000000000002 108.846 177.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.611 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 6.2 tt0 . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 114.8 -1.091 . . . . 1.45 111.084 -177.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.884 HG23 ' H ' ' A' ' 42' ' ' GLU . 2.6 t . . . . . 0 N--CA 1.448 -0.525 0 N-CA-C 109.931 -0.396 . . . . 1.1200000000000001 109.931 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.884 ' H ' HG23 ' A' ' 41' ' ' THR . 14.5 pt-20 -93.32 -31.66 14.59 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.618 1.199 . . . . 2.02 108.631 166.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 1.002 ' HA ' HG13 ' A' ' 46' ' ' VAL . 39.4 m -68.94 -17.21 63.92 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 113.071 -1.877 . . . . 1.25 114.68 -167.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -52.82 -39.82 62.76 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 118.439 0.563 . . . . 1.9099999999999999 111.001 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -82.08 -40.38 22.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.592 -0.276 . . . . 0.52000000000000002 111.205 176.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 1.002 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.8 m -69.43 -36.95 74.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.896 -0.321 . . . . 1.4099999999999999 111.313 -175.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -71.27 -34.94 71.15 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 108.776 -0.824 . . . . 0.67000000000000004 108.776 178.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.596 HE22 ' HD3' ' A' ' 51' ' ' ARG . 4.3 mm100 -64.21 -32.88 74.63 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.161 -0.927 . . . . 0.98999999999999999 110.42 177.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.682 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -77.42 -42.44 36.13 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.886 -0.597 . . . . 0.41999999999999998 110.779 175.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.498 HD12 ' CE2' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -66.51 -23.13 66.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.001 -0.545 . . . . 1.3300000000000001 112.242 -176.387 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.596 ' HD3' HE22 ' A' ' 48' ' ' GLN . 16.2 ptm180 -78.12 -29.13 48.72 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 107.863 -1.162 . . . . 2.1699999999999999 107.863 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.946 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 6.6 mm-40 -74.42 -52.13 12.93 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 113.565 -1.652 . . . . 1.1000000000000001 109.835 177.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.07 -44.39 92.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.823 -0.626 . . . . 0.53000000000000003 111.025 178.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.58 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.86 -36.04 92.84 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 121.045 -0.598 . . . . 0.69999999999999996 111.984 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -64.33 -37.11 86.34 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 110.34 -0.245 . . . . 1.04 110.34 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.534 ' HA ' HD11 ' A' ' 59' ' ' LEU . 24.3 mm-40 -60.5 -27.06 67.3 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.544 0.528 . . . . 2.29 111.292 177.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.579 ' HD2' ' HB3' ' A' ' 105' ' ' SER . 36.8 t80 -80.33 -26.4 38.77 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.986 0.422 . . . . 2.29 110.271 175.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.58 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 46.4 mt-10 -67.94 -60.78 2.24 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.933 -0.576 . . . . 1.3 111.951 -174.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.612 HD22 ' N ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -55.71 -33.76 64.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 118.18 0.445 . . . . 1.54 110.995 -178.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.612 ' N ' HD22 ' A' ' 59' ' ' LEU . 59.7 mtt180 -60.22 -62.65 1.71 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.759 -0.655 . . . . 2.5800000000000001 112.049 172.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -92.71 -2.98 55.58 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.339 0.866 . . . . 5.3200000000000003 113.339 -168.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.868 ' HA ' ' CE2' ' A' ' 65' ' ' PHE . 32.6 ttt180 -52.81 -45.61 67.31 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.895 0.702 . . . . 4.4800000000000004 112.895 -171.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -69.56 -14.04 62.64 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.964 -0.294 . . . . 4.7199999999999998 111.212 -178.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.664 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.35 -60.77 1.84 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.012 0.375 . . . . 1.1699999999999999 112.012 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.89 ' HA ' HD11 ' A' ' 68' ' ' LEU . 4.9 p90 -57.88 -29.45 65.04 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.751 1.019 . . . . 2.8100000000000001 113.751 -167.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.3 t -90.74 -11.33 39.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.312 0.577 . . . . 2.1899999999999999 110.43 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -90.8 -50.97 5.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.779 0.8 . . . . 2.7200000000000002 110.413 -177.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.984 HD13 HD11 ' A' ' 72' ' ' LEU . 0.4 OUTLIER -67.44 -4.29 10.85 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.357 -1.292 . . . . 1.5600000000000001 114.4 -174.372 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.803 ' HA ' HD13 ' A' ' 72' ' ' LEU . 3.2 p -45.78 -23.75 0.3 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 118.779 0.718 . . . . 0.69999999999999996 112.86 -171.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 73.7 m -46.48 -60.15 2.53 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.1 0.56 . . . . 1.3400000000000001 111.508 166.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.686 HE21 ' CB ' ' A' ' 68' ' ' LEU . 2.0 mp0 -47.79 -51.5 22.27 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 124.441 1.097 . . . . 1.4199999999999999 111.39 176.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.984 HD11 HD13 ' A' ' 68' ' ' LEU . 2.9 mp -77.59 -19.82 54.97 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.236 -1.347 . . . . 1.3700000000000001 111.339 -166.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.9 t-80 54.54 50.0 17.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.817 0.818 . . . . 2.7200000000000002 109.103 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.731 HG13 HG22 ' A' ' 69' ' ' THR . 30.9 mm -57.44 105.67 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 114.113 -1.403 . . . . 0.91000000000000003 111.33 -177.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.757 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.91 -169.55 0.22 Allowed Pre-proline 0 C--N 1.315 -0.913 0 N-CA-C 107.022 -1.473 . . . . 0.51000000000000001 107.022 -169.146 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.757 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 65.9 Cg_exo -28.92 165.38 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 124.674 3.583 . . . . 0.46999999999999997 115.236 164.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.647 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -28.72 -32.67 0.01 OUTLIER Glycine 0 N--CA 1.469 0.834 0 N-CA-C 117.523 1.769 . . . . 0.40000000000000002 117.523 -171.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.443 ' N ' ' O ' ' A' ' 76' ' ' PRO . 37.3 p -64.43 3.67 0.45 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 118.125 0.962 . . . . 0.56000000000000005 112.618 -176.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.1 -14.36 62.96 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.235 0.54 . . . . 0.34000000000000002 109.608 171.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.647 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 13.3 p90 -72.66 -20.81 61.18 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.791 -0.64 . . . . 4.1299999999999999 109.44 175.115 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.479 ' O ' ' HG3' ' A' ' 85' ' ' GLN . 57.0 mt-30 -79.08 -30.05 43.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.442 0.639 . . . . 1.03 109.854 177.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -70.55 -49.17 50.82 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.9 -1.045 . . . . 0.47999999999999998 109.263 173.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.491 ' O ' HG13 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -68.72 -16.69 63.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.053 -1.431 . . . . 1.1799999999999999 110.773 176.264 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.578 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.5 tt0 -70.71 -52.43 21.0 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.086 -0.507 . . . . 0.80000000000000004 110.809 178.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' A' ' 81' ' ' GLN . 58.4 mt-30 -45.64 -40.53 9.16 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 114.802 -1.09 . . . . 1.6200000000000001 111.207 -179.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.918 ' HA ' ' HA2' ' B' 1005 ' ' GLY . 1.2 p -86.47 -47.71 16.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-N 113.55 -1.659 . . . . 1.3 111.697 -173.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.578 HG12 ' HA ' ' A' ' 84' ' ' GLU . 8.1 p -61.95 -24.95 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.882 0.849 . . . . 0.84999999999999998 109.835 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.451 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 0.6 OUTLIER -62.11 -44.83 95.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.266 -1.334 . . . . 0.91000000000000003 110.629 178.518 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.844 ' HB3' ' HB2' ' B' 1009 ' ' ALA . 7.9 mm-40 -71.66 -37.92 70.73 Favored 'General case' 0 CA--C 1.495 -1.164 0 CA-C-O 121.719 0.771 . . . . 2.8700000000000001 109.758 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.514 HD23 ' HD2' ' A' ' 99' ' ' ARG . 16.3 mt -59.78 -19.03 47.95 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 113.781 -1.554 . . . . 1.28 111.884 -172.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.654 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 84.9 t80 -105.04 -35.58 7.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.51 0.672 . . . . 2.2999999999999998 111.489 -177.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.451 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 8.4 ptm180 -84.0 -36.41 23.18 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.863 -0.608 . . . . 5.0599999999999996 111.471 -172.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -95.85 21.21 8.83 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.901 -0.59 . . . . 3.1200000000000001 112.58 -170.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.19 68.41 0.11 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 117.665 -2.207 . . . . 2.3100000000000001 115.814 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.654 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 60.8 t -74.98 102.1 2.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 118.599 1.2 . . . . 1.0600000000000001 111.243 174.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.506 HD22 ' HB2' ' A' ' 99' ' ' ARG . 0.3 OUTLIER -111.54 -173.18 2.19 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.547 -1.206 . . . . 2.1200000000000001 108.402 173.072 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.573 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 7.5 m95 -61.98 -55.31 30.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.707 0.289 . . . . 3.3399999999999999 111.245 177.092 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.68 -15.46 71.09 Favored Glycine 0 CA--C 1.519 0.314 0 C-N-CA 120.943 -0.646 . . . . 0.68999999999999995 113.097 -178.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.592 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 20.3 tpp180 -69.82 -43.49 71.91 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.218 0.532 . . . . 4.2400000000000002 110.622 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.481 ' O ' ' HD1' ' A' ' 104' ' ' PHE . 61.2 mt -68.09 -34.98 69.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.447 -0.797 . . . . 0.44 111.38 -175.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -60.74 -29.19 44.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 120.841 0.353 . . . . 1.3500000000000001 110.774 179.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.436 ' O ' ' HD1' ' A' ' 106' ' ' PHE . . . -62.55 -46.93 86.1 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.447 0.641 . . . . 0.44 110.268 177.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.619 ' HA ' ' CE1' ' A' ' 106' ' ' PHE . 30.8 t80 -53.43 -37.71 62.82 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.356 -1.293 . . . . 1.49 111.211 177.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.671 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 47.7 m-85 -76.53 -39.47 52.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.298 -0.41 . . . . 3.29 111.116 178.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.689 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 22.6 t -63.04 -54.86 31.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.013 -0.54 . . . . 1.1899999999999999 111.317 -176.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.619 ' CE1' ' HA ' ' A' ' 103' ' ' PHE . 3.9 p90 -76.81 -23.51 52.82 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.436 -0.506 . . . . 2.8900000000000001 110.41 -177.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.38 -44.64 73.12 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 110.8 -0.92 . . . . 0.29999999999999999 110.8 174.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.993 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.32 -31.18 79.64 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.874 -0.679 . . . . 0.23000000000000001 111.53 175.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -76.0 -28.87 57.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.787 0.327 . . . . 0.31 110.745 176.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.46 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.66 -41.78 98.17 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.083 -1.08 . . . . 1.1200000000000001 108.083 178.366 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.699 ' SG ' HG22 ' A' ' 123' ' ' VAL . 16.9 t -49.63 -51.66 36.14 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 113.449 -1.705 . . . . 0.26000000000000001 110.964 172.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.538 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 69.1 t -65.66 -40.94 89.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.346 -0.388 . . . . 0.34999999999999998 111.924 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.714 ' HB3' HG21 ' A' ' 74' ' ' ILE . 18.3 mm-40 -63.03 -22.85 67.14 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.238 0.542 . . . . 2.5099999999999998 110.499 178.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.488 ' HB3' ' HB2' ' A' ' 122' ' ' LEU . 26.4 m -76.99 -37.76 54.5 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.977 -0.749 . . . . 0.28000000000000003 108.977 174.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' ' 111' ' ' CYS . 98.1 t -66.17 -35.11 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.147 -0.933 . . . . 1.23 109.332 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.512 ' OD2' ' HD3' ' A' ' 117' ' ' LYS . 25.9 t70 -52.0 -51.22 58.76 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 113.48 -1.691 . . . . 0.59999999999999998 111.597 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.512 ' HD3' ' OD2' ' A' ' 116' ' ' ASP . 12.7 mmtp -85.38 13.78 6.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.017 -0.538 . . . . 1.6200000000000001 110.282 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.464 ' HA ' HE21 ' A' ' 120' ' ' GLN . 46.1 mt-10 61.79 44.38 8.68 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.715 0.769 . . . . 1.8799999999999999 110.53 -178.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.494 ' HB3' HD23 ' A' ' 122' ' ' LEU . 25.8 mtm -119.74 44.8 2.3 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 107.871 -1.159 . . . . 0.31 107.871 -179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.464 HE21 ' HA ' ' A' ' 118' ' ' GLU . 3.1 mt-30 -60.4 -7.2 1.9 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.52 -1.218 . . . . 1.1499999999999999 112.845 -175.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.508 HG23 HD22 ' A' ' 122' ' ' LEU . 27.4 m -67.29 -25.14 32.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.628 0.251 . . . . 0.46000000000000002 111.205 172.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.523 HD13 ' HD3' ' A' ' 125' ' ' ARG . 3.5 mm? -70.93 -29.33 65.34 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 110.161 -0.311 . . . . 0.26000000000000001 110.161 177.449 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.699 HG22 ' SG ' ' A' ' 111' ' ' CYS . 72.2 t -44.79 -53.57 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 123.841 0.713 . . . . 0.25 111.78 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.61 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 0.0 OUTLIER -70.68 -37.15 73.6 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 116.057 -0.52 . . . . 1.3500000000000001 111.244 -179.565 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.523 ' HD3' HD13 ' A' ' 122' ' ' LEU . 60.8 mtp180 -62.36 -57.05 12.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 116.142 -0.481 . . . . 2.6699999999999999 110.502 -179.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.581 HG22 ' SD ' ' A' ' 130' ' ' MET . 76.7 mt -52.53 -49.82 42.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.677 -0.692 . . . . 0.23000000000000001 110.613 -178.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.593 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.96 -36.84 70.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.942 0.401 . . . . 0.28999999999999998 111.193 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.75 -60.86 2.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.336 0.589 . . . . 0.28000000000000003 110.397 176.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -60.17 -32.61 71.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.638 -1.165 . . . . 3.9100000000000001 111.227 -176.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.584 ' SD ' HD11 ' A' ' 13' ' ' LEU . 89.2 mtp -63.51 -56.43 16.11 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.954 0.407 . . . . 1.0800000000000001 110.765 177.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.441 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -61.17 -37.03 81.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.27 -0.423 . . . . 0.25 110.545 179.394 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.425 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 98.0 m -63.22 -45.12 93.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.454 -0.339 . . . . 0.40000000000000002 111.232 177.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -56.45 -40.34 74.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.176 0.512 . . . . 3.1299999999999999 109.877 177.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 1.001 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.2 tt -65.06 -49.67 69.17 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.313 -0.625 . . . . 0.94999999999999996 109.313 175.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . 0.425 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 4.7 m-80 -49.91 -49.12 50.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.792 -0.64 . . . . 0.46000000000000002 111.905 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -81.97 -54.54 5.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.15 -0.477 . . . . 0.58999999999999997 111.86 -176.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.76 -51.03 5.43 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.283 0.846 . . . . 1.45 113.283 -169.012 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 1.001 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -79.88 -44.18 20.91 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 114.054 1.131 . . . . 1.2 114.054 -165.006 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.622 ' HA ' HD12 ' A' ' 142' ' ' ILE . 37.0 tt0 -47.18 -51.73 39.65 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 112.69 0.626 . . . . 0.75 112.69 -174.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.579 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 51.1 Cg_exo -52.75 -50.66 13.29 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 121.962 1.774 . . . . 0.56000000000000005 111.784 177.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 4.2 t-105 -58.44 -50.75 72.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.51 -0.768 . . . . 1.2 110.441 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.622 HD12 ' HA ' ' A' ' 139' ' ' GLU . 54.7 mt -46.43 -53.87 2.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.117 -0.492 . . . . 0.32000000000000001 111.613 175.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.603 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 78.3 mm-40 -59.16 -34.15 71.76 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.689 -0.687 . . . . 0.56999999999999995 111.723 -178.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 67.8 mm-40 -63.3 -25.76 68.46 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.573 0.701 . . . . 0.78000000000000003 111.029 177.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.623 ' N ' HD22 ' A' ' 145' ' ' ASN . 0.7 OUTLIER -96.06 -16.67 21.46 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.182 -0.917 . . . . 0.93000000000000005 109.625 -171.855 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 142.62 -40.05 1.3 Allowed Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.478 -0.783 . . . . 0.56000000000000005 112.665 175.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . 0.542 ' H ' ' HH2' ' A' ' 97' ' ' TRP . . . 120.36 170.62 14.3 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.958 -0.639 . . . . 0.48999999999999999 111.675 -178.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.696 ' HZ2' HD21 ' A' ' 134' ' ' LEU . 6.8 m0 -65.92 -35.09 79.65 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.923 0.342 . . . . 3.5699999999999998 111.923 -175.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.542 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 8.8 m-20 -63.23 -31.08 72.14 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.697 0.284 . . . . 1.96 110.247 177.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.531 ' O ' HD13 ' A' ' 154' ' ' LEU . 72.3 m -70.11 -36.06 74.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.416 -0.356 . . . . 0.67000000000000004 110.867 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.573 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 91.1 t80 -62.27 -33.45 74.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.787 -0.82 . . . . 3.0 108.787 178.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.542 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 90.8 t -63.88 -52.83 51.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 114.438 -1.255 . . . . 1.1499999999999999 111.131 174.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.517 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 24.0 mm-40 -48.75 -46.99 41.97 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.125 -0.943 . . . . 1.6699999999999999 111.643 176.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.531 HD13 ' O ' ' A' ' 150' ' ' THR . 8.2 mp -78.17 -60.81 2.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.998 0.74 . . . . 1.3 112.998 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -119.85 27.48 8.67 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.187 -0.46 . . . . 4.2400000000000002 110.632 -167.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.682 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -57.62 165.44 6.44 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 115.619 -0.719 . . . . 1.1000000000000001 114.336 -179.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.946 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 29.4 t-20 . . . . . 0 C--N 1.316 -0.888 0 CA-C-N 113.308 -1.446 . . . . 1.29 112.107 -177.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . 0.918 ' HA2' ' HA ' ' A' ' 86' ' ' VAL . . . . . . . . 0 N--CA 1.43 -1.702 0 N-CA-C 110.594 -1.002 . . . . 1.2 110.594 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' B' 1006 ' ' ARG . 29.4 mmt180 -56.63 -40.31 75.18 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 111.989 0.366 . . . . 2.8799999999999999 111.989 176.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -66.98 -52.39 43.35 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 120.692 0.282 . . . . 1.3100000000000001 111.456 -175.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.819 ' HB2' HG23 ' A' ' 86' ' ' VAL . 3.8 mm? -75.14 -37.41 61.39 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.842 0.353 . . . . 1.3300000000000001 110.872 -174.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 0.844 ' HB2' ' HB3' ' A' ' 89' ' ' GLU . . . -45.72 -47.54 15.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.743 0.782 . . . . 0.88 110.057 165.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -75.56 -60.4 2.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.726 -1.124 . . . . 1.03 112.121 -177.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -59.0 -33.25 70.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.945 -0.571 . . . . 1.6699999999999999 111.829 -176.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -67.2 -20.79 71.5 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.886 -0.673 . . . . 0.78000000000000003 113.417 -175.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 28.3 t70 -67.56 -20.16 65.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.868 0.334 . . . . 1.8999999999999999 111.213 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 10.6 m . . . . . 0 C--O 1.227 -0.106 0 CA-C-O 120.901 0.381 . . . . 1.4399999999999999 110.952 -175.906 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 121.643 0.735 . . . . 2.4199999999999999 110.008 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 m -69.77 -15.42 63.13 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.02 -0.991 . . . . 1.25 112.351 -176.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.592 ' HB3' HD22 ' A' ' 134' ' ' LEU . 1.1 p30 -61.19 -18.7 59.57 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.092 -0.504 . . . . 1.78 110.848 175.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.558 ' O ' HG23 ' A' ' 10' ' ' VAL . 20.0 tpp85 -60.25 -45.5 93.04 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.861 -0.609 . . . . 1.3999999999999999 109.844 175.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -59.56 -52.86 63.72 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.827 -0.624 . . . . 0.68000000000000005 111.274 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.57 HD22 ' HA ' ' A' ' 5' ' ' ASN . 2.7 mp -45.66 -37.46 5.76 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.223 -0.899 . . . . 1.1599999999999999 111.47 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 70.0 t -76.81 -62.52 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.055 -0.521 . . . . 0.27000000000000002 110.659 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 6' ' ' ARG . 86.5 t -52.14 -49.96 37.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.373 -0.831 . . . . 0.33000000000000002 112.841 -174.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -54.07 -32.64 55.28 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.508 0.505 . . . . 0.58999999999999997 110.653 -175.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.558 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 55.7 t80 -84.12 -44.64 13.82 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.285 -0.416 . . . . 1.6100000000000001 111.548 -179.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.889 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.7 mp -58.13 -40.5 81.42 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 120.024 -0.67 . . . . 0.34000000000000002 109.98 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.413 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 23.1 t -60.73 -40.89 94.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.99 -0.55 . . . . 1.05 110.312 176.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -73.51 -25.39 60.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.814 -0.63 . . . . 1.22 111.309 -178.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.716 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.6 OUTLIER -78.52 -50.24 11.95 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-O 121.226 0.536 . . . . 1.4099999999999999 110.094 -174.637 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.701 HD21 ' SG ' ' A' ' 111' ' ' CYS . 13.2 mt -55.18 -29.78 58.56 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.511 -0.768 . . . . 1.3500000000000001 111.277 173.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.7 t -60.81 -29.02 69.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.47 -0.787 . . . . 0.93999999999999995 111.908 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.716 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 20.8 pt20 -75.29 -16.72 60.41 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.201 0.524 . . . . 1.3700000000000001 110.932 -176.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.798 ' HD2' HG22 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -100.66 -23.69 14.59 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 122.197 0.999 . . . . 2.2000000000000002 108.58 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.01 26.28 7.55 Favored Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 113.651 -1.613 . . . . 0.53000000000000003 112.468 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.489 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 86.8 m-85 -112.61 166.61 11.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.542 0.21 . . . . 0.76000000000000001 110.801 176.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.1 t -109.31 151.29 26.79 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.263 -0.426 . . . . 0.52000000000000002 110.632 -178.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.671 ' CH2' ' HB2' ' A' ' 31' ' ' GLU . 3.0 t90 -75.06 -52.9 9.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.073 -0.512 . . . . 3.3599999999999999 110.356 175.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.433 ' HB2' ' CE3' ' A' ' 24' ' ' TRP . 22.6 t -72.45 -18.55 61.68 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.227 -0.442 . . . . 1.3700000000000001 111.495 -172.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -65.53 -22.48 66.72 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.191 -0.604 . . . . 1.1100000000000001 110.785 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -108.96 -33.75 6.83 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.826 -0.625 . . . . 1.28 110.863 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.701 ' HB3' HG22 ' A' ' 30' ' ' VAL . 10.6 m -101.54 143.84 31.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.71 0.767 . . . . 1.8100000000000001 112.112 -177.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.502 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 15.4 t70 -108.15 -7.4 16.05 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.162 -1.381 . . . . 2.3100000000000001 109.383 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.843 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.0 m -53.61 -72.97 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 114.067 -1.424 . . . . 0.92000000000000004 112.915 -170.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.843 ' H ' HG23 ' A' ' 30' ' ' VAL . 20.5 mm-40 -91.57 1.5 57.1 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.965 -0.754 . . . . 2.7400000000000002 108.965 178.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.502 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.1 tt0 . . . . . 0 N--CA 1.446 -0.639 0 CA-C-N 114.834 -1.075 . . . . 1.45 110.205 179.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.698 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.3 t . . . . . 0 CA--C 1.541 0.617 0 N-CA-C 110.145 -0.317 . . . . 1.1200000000000001 110.145 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.698 ' H ' HG23 ' A' ' 41' ' ' THR . 0.0 OUTLIER -92.18 -34.98 14.09 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.551 0.691 . . . . 2.02 109.393 169.095 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.772 ' HA ' HG13 ' A' ' 46' ' ' VAL . 7.3 p -47.95 -39.29 18.89 Favored 'General case' 0 C--O 1.214 -0.794 0 CA-C-N 113.943 -1.481 . . . . 1.25 112.846 -171.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -39.4 -51.17 2.11 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 123.946 0.779 . . . . 1.9099999999999999 111.989 -175.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.418 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -75.72 -42.61 50.29 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 121.186 -0.206 . . . . 0.52000000000000002 111.414 179.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.772 HG13 ' HA ' ' A' ' 43' ' ' SER . 0.5 OUTLIER -68.0 -44.87 84.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 N-CA-C 111.652 0.241 . . . . 1.4099999999999999 111.652 -175.902 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.769 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.0 ptpt -67.35 -39.3 85.73 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.293 -0.632 . . . . 0.67000000000000004 109.293 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.491 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 5.6 mm100 -57.83 -43.83 86.07 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 115.631 -0.713 . . . . 0.98999999999999999 111.635 174.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.588 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -70.46 -34.95 73.0 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.243 0.544 . . . . 0.41999999999999998 110.42 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.451 ' HG ' ' CE1' ' A' ' 104' ' ' PHE . 4.0 tp -64.84 -28.48 69.58 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.322 -0.854 . . . . 1.3300000000000001 111.695 -175.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.427 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 3.8 ptp85 -86.88 -23.04 25.37 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.271 0.558 . . . . 2.1699999999999999 110.108 -177.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.569 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.3 mm-40 -70.63 -47.42 60.14 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.091 -0.959 . . . . 1.1000000000000001 109.826 175.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.03 -36.47 75.09 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.736 -0.665 . . . . 0.53000000000000003 109.438 171.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.63 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -57.9 -44.54 94.37 Favored Glycine 0 C--O 1.219 -0.79 0 CA-C-N 114.995 -1.002 . . . . 0.69999999999999996 112.276 178.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -52.36 -44.59 65.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.906 0.384 . . . . 1.04 111.329 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 41.6 mt-10 -67.47 -29.05 68.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.791 -0.641 . . . . 2.29 111.721 179.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.5 ' HE1' ' HA2' ' B' 1012 ' ' GLY . 13.4 m-85 -81.03 -41.96 21.85 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.973 -0.558 . . . . 2.29 111.255 176.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.63 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.0 mt-10 -55.85 -50.02 71.73 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.189 0.519 . . . . 1.3 109.869 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.463 HD12 ' N ' ' A' ' 60' ' ' ARG . 3.8 pp -64.6 -35.05 79.73 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.232 -0.894 . . . . 1.54 110.648 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.463 ' N ' HD12 ' A' ' 59' ' ' LEU . 8.6 ttt180 -70.1 -44.96 67.96 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 120.377 -0.529 . . . . 2.5800000000000001 111.203 -167.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -90.54 -3.75 57.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.294 -0.412 . . . . 5.3200000000000003 111.196 -179.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.529 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 51.2 ttp180 -50.06 -37.23 32.46 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.174 0.805 . . . . 4.4800000000000004 113.174 -171.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 -66.97 -38.79 86.74 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.985 0.422 . . . . 4.7199999999999998 110.937 -179.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.666 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.76 -42.82 9.36 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.603 0.964 . . . . 1.1699999999999999 113.603 -172.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.529 ' CD1' ' HA ' ' A' ' 62' ' ' ARG . 8.1 p90 -52.69 -39.13 61.68 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.045 1.128 . . . . 2.8100000000000001 114.045 -161.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.9 t -85.49 -21.74 28.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.155 0.502 . . . . 2.1899999999999999 110.066 -175.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -77.46 -31.84 54.07 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.038 -0.727 . . . . 2.7200000000000002 109.038 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.666 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 61.8 mt -63.46 -15.09 56.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.975 -1.011 . . . . 1.5600000000000001 112.032 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.777 HG22 HG13 ' A' ' 74' ' ' ILE . 17.5 p -54.36 -37.06 64.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.254 0.55 . . . . 0.69999999999999996 110.474 -177.158 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 67.2 m -61.71 -31.51 71.66 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.063 -0.971 . . . . 1.3400000000000001 111.123 176.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.58 ' NE2' HD22 ' A' ' 68' ' ' LEU . 10.2 mt-30 -80.69 -47.69 13.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.603 -0.726 . . . . 1.4199999999999999 110.224 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.586 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mp -68.1 -31.81 71.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.544 -0.753 . . . . 1.3700000000000001 110.444 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.442 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 50.4 m-70 68.51 64.06 0.34 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.607 0.718 . . . . 2.7200000000000002 109.91 -173.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.777 HG13 HG22 ' A' ' 69' ' ' THR . 26.0 mm -65.02 108.88 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.477 -1.238 . . . . 0.91000000000000003 110.594 178.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.738 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.83 -171.49 0.27 Allowed Pre-proline 0 C--N 1.316 -0.869 0 N-CA-C 107.45 -1.315 . . . . 0.51000000000000001 107.45 -169.396 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.738 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.0 Cg_exo -30.91 166.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 124.777 3.652 . . . . 0.46999999999999997 114.766 164.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.489 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.33 -28.87 0.01 OUTLIER Glycine 0 N--CA 1.476 1.353 0 N-CA-C 117.225 1.65 . . . . 0.40000000000000002 117.225 -173.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.46 ' N ' ' O ' ' A' ' 76' ' ' PRO . 31.2 p -68.87 3.46 1.96 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.838 0.819 . . . . 0.56000000000000005 112.0 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.02 -14.51 61.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.184 0.516 . . . . 0.34000000000000002 109.675 170.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.452 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 44.0 t80 -75.54 -22.79 56.75 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.761 -0.654 . . . . 4.1299999999999999 109.372 174.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.445 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 34.0 mt-30 -82.57 -23.9 34.23 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.625 0.726 . . . . 1.03 109.865 174.093 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 13.7 m -72.68 -53.76 10.86 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 114.557 -1.201 . . . . 0.47999999999999998 109.565 171.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.436 ' HA ' HG23 ' A' ' 86' ' ' VAL . 85.3 t80 -65.79 -17.92 64.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.029 -0.987 . . . . 1.1799999999999999 110.229 175.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.604 ' HA ' HG12 ' A' ' 87' ' ' VAL . 34.7 tt0 -60.9 -49.34 77.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.884 -0.598 . . . . 0.80000000000000004 110.389 177.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -50.6 -34.31 25.42 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.988 -1.006 . . . . 1.6200000000000001 110.622 176.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.596 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 1.8 t -80.63 -51.54 15.64 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 114.646 -1.161 . . . . 1.3 110.602 -176.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.604 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.0 p -63.54 -21.75 29.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.826 0.822 . . . . 0.84999999999999998 109.841 -179.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.2 m-80 -78.53 -45.49 21.76 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.367 -1.288 . . . . 0.91000000000000003 111.615 175.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 1.028 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 16.2 pt-20 -69.57 -32.3 70.98 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 107.961 -1.125 . . . . 2.8700000000000001 107.961 -178.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.596 ' HB2' ' O ' ' A' ' 86' ' ' VAL . 0.2 OUTLIER -60.61 -31.06 70.25 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 113.182 -1.827 . . . . 1.28 111.152 177.983 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.677 ' HA ' HG22 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -99.27 -38.29 8.93 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.07 0.462 . . . . 2.2999999999999998 111.29 -169.533 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.56 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 10.3 ptm180 -72.65 -34.22 67.11 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.652 -0.704 . . . . 5.0599999999999996 110.586 -174.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -89.13 8.63 29.02 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.851 -1.068 . . . . 3.1200000000000001 112.31 -172.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.68 72.52 0.11 Allowed Glycine 0 C--N 1.337 0.618 0 C-N-CA 117.01 -2.519 . . . . 2.3100000000000001 116.15 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.874 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 48.8 t -71.1 92.62 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 CA-C-N 119.053 1.427 . . . . 1.0600000000000001 111.361 177.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.434 ' ND2' ' N ' ' A' ' 96' ' ' ASN . 1.1 m120 -114.65 -170.81 1.81 Allowed 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.493 -1.23 . . . . 2.1200000000000001 108.854 178.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.843 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 13.4 m-90 -58.84 -38.0 77.72 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.064 0.459 . . . . 3.3399999999999999 110.865 177.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.553 ' O ' ' HB ' ' A' ' 101' ' ' VAL . . . -83.47 -32.19 25.66 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.91 -0.662 . . . . 0.68999999999999995 114.536 -170.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.874 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 0.6 OUTLIER -69.1 -30.08 68.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 118.078 0.939 . . . . 4.2400000000000002 109.587 -176.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 82.2 mt -69.81 -34.19 59.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.4 0.619 . . . . 0.44 109.53 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.553 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 79.5 t -55.03 -58.66 3.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 114.935 -1.029 . . . . 1.3500000000000001 110.045 168.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -51.39 -41.74 60.92 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.773 -0.649 . . . . 0.44 110.873 176.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -59.78 -54.3 47.9 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.441 -0.799 . . . . 1.49 112.02 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.496 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.4 OUTLIER -72.76 -23.53 60.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.035 0.445 . . . . 3.29 110.435 -176.44 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.558 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 13.3 t -76.32 -53.88 7.57 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.794 -0.639 . . . . 1.1899999999999999 110.521 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -66.9 -28.07 68.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.009 0.433 . . . . 2.8900000000000001 109.911 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.487 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -65.72 -44.09 93.0 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.79 -0.641 . . . . 0.29999999999999999 111.71 174.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.889 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.79 -35.27 91.8 Favored Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.461 -0.876 . . . . 0.23000000000000001 111.222 175.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.73 -28.91 65.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.556 -0.322 . . . . 0.31 110.81 177.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.417 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.24 -39.62 95.12 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.171 -1.048 . . . . 1.1200000000000001 108.171 179.407 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.701 ' SG ' HD21 ' A' ' 17' ' ' LEU . 42.1 t -55.24 -53.04 61.12 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 113.989 -1.46 . . . . 0.26000000000000001 110.735 174.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.798 HG22 ' HD2' ' A' ' 20' ' ' LYS . 65.9 t -63.14 -39.6 85.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.403 -0.362 . . . . 0.34999999999999998 111.852 -177.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.463 ' HB3' HG21 ' A' ' 74' ' ' ILE . 2.5 mm-40 -65.57 -22.89 66.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.058 0.456 . . . . 2.5099999999999998 110.917 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.412 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 49.1 m -79.28 -41.34 28.32 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.903 -0.777 . . . . 0.28000000000000003 108.903 175.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.594 HG21 ' CD2' ' A' ' 17' ' ' LEU . 98.0 t -65.42 -32.94 60.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 114.999 -1.0 . . . . 1.23 109.293 179.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.36 -50.55 59.3 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 113.313 -1.767 . . . . 0.59999999999999998 111.411 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.423 ' HB2' ' HG3' ' A' ' 119' ' ' MET . 10.9 mmtp -87.03 11.07 14.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.829 -0.623 . . . . 1.6200000000000001 110.441 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.549 ' HA ' HE21 ' A' ' 120' ' ' GLN . 39.7 mt-10 66.03 43.56 2.92 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-O 121.662 0.744 . . . . 1.8799999999999999 110.227 -178.075 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.423 ' HG3' ' HB2' ' A' ' 117' ' ' LYS . 26.6 mtm -118.22 48.42 1.42 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.073 -1.084 . . . . 0.31 108.073 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.549 HE21 ' HA ' ' A' ' 118' ' ' GLU . 2.4 mt-30 -63.73 -7.27 7.18 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.641 -1.163 . . . . 1.1499999999999999 112.529 -175.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.516 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 34.2 m -65.19 -27.2 41.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 120.708 0.29 . . . . 0.46000000000000002 110.918 174.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.706 HD13 ' HD2' ' A' ' 125' ' ' ARG . 2.9 mm? -72.48 -27.33 62.22 Favored 'General case' 0 CA--C 1.51 -0.562 0 CA-C-N 116.589 -0.278 . . . . 0.26000000000000001 110.684 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.68 HG22 ' SG ' ' A' ' 111' ' ' CYS . 70.3 t -44.22 -53.44 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 O-C-N 123.8 0.687 . . . . 0.25 111.938 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.2 -35.69 66.4 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.756 -0.656 . . . . 1.3500000000000001 111.393 -178.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.706 ' HD2' HD13 ' A' ' 122' ' ' LEU . 70.8 mtt180 -64.78 -52.53 56.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.827 -0.624 . . . . 2.6699999999999999 110.344 -178.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.592 HG22 ' SD ' ' A' ' 130' ' ' MET . 73.1 mt -54.11 -51.89 42.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.605 -0.725 . . . . 0.23000000000000001 110.785 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.674 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -57.46 -36.34 71.3 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.713 0.292 . . . . 0.28999999999999998 111.417 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.27 -58.8 6.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.288 0.566 . . . . 0.28000000000000003 110.67 177.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -64.24 -33.71 76.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.021 -0.99 . . . . 3.9100000000000001 111.49 -176.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.592 ' SD ' HG22 ' A' ' 126' ' ' ILE . 88.8 mtp -61.96 -54.59 39.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.04 0.448 . . . . 1.0800000000000001 110.75 178.333 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.89 94.8 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.798 -0.637 . . . . 0.25 111.086 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 92.0 m -62.75 -43.9 97.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.875 0.369 . . . . 0.40000000000000002 110.776 178.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.573 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 71.8 t80 -56.34 -42.85 78.39 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.226 -0.443 . . . . 3.1299999999999999 110.032 176.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.933 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 4.9 tt -63.36 -48.01 79.72 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.102 -0.703 . . . . 0.94999999999999996 109.102 175.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -49.83 -55.67 13.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.895 -0.593 . . . . 0.46000000000000002 112.59 178.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -83.49 -47.2 11.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.064 0.459 . . . . 0.58999999999999997 111.82 -173.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . 0.573 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 44.3 m-70 -90.92 -51.36 5.39 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 112.756 0.65 . . . . 1.45 112.756 -170.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.933 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -83.23 -46.59 12.49 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 114.515 1.302 . . . . 1.2 114.515 -165.072 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.603 ' HA ' HD12 ' A' ' 142' ' ' ILE . 28.3 tt0 -44.98 -52.42 19.4 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.432 0.53 . . . . 0.75 112.432 -173.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.619 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.3 Cg_exo -53.38 -53.52 6.49 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.654 1.57 . . . . 0.56000000000000005 111.715 176.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -55.0 -51.11 67.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.583 -0.735 . . . . 1.2 110.347 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.603 HD12 ' HA ' ' A' ' 139' ' ' GLU . 73.6 mt -46.83 -53.89 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.823 -0.626 . . . . 0.32000000000000001 111.805 174.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.601 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 77.3 mm-40 -61.95 -29.87 70.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.896 -0.593 . . . . 0.56999999999999995 111.725 -178.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.619 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.6 mm-40 -64.81 -20.77 66.57 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.78 0.8 . . . . 0.78000000000000003 109.898 175.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.649 ' N ' HD22 ' A' ' 145' ' ' ASN . 0.7 OUTLIER -104.23 2.26 31.46 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.89 -1.05 . . . . 0.93000000000000005 108.783 -176.652 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 127.1 -54.39 0.77 Allowed Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 114.668 -1.151 . . . . 0.56000000000000005 112.011 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . 0.453 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 137.41 -177.75 19.59 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.922 -0.656 . . . . 0.48999999999999999 111.784 -177.439 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.442 ' HE1' HD13 ' A' ' 142' ' ' ILE . 11.8 m0 -68.02 -45.63 73.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.179 0.514 . . . . 3.5699999999999998 110.084 -179.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -63.72 -34.57 78.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.458 -0.792 . . . . 1.96 111.123 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.579 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 66.0 m -66.77 -30.66 70.92 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.493 -0.322 . . . . 0.67000000000000004 111.702 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.843 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 86.8 t80 -59.14 -38.54 79.95 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.339 -0.544 . . . . 3.0 109.84 174.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -75.83 -25.73 17.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.261 -0.427 . . . . 1.1499999999999999 110.19 177.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.575 ' CG ' ' HA ' ' A' ' 150' ' ' THR . 55.1 mt-10 -55.52 -31.0 61.71 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-O 121.216 0.531 . . . . 1.6699999999999999 109.835 172.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 150' ' ' THR . 0.6 OUTLIER -101.92 -50.67 3.61 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.397 -0.819 . . . . 1.3 110.984 -176.664 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . 0.46 ' CD2' ' HB2' ' A' ' 154' ' ' LEU . 97.9 m-85 -120.69 26.08 9.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.789 -0.641 . . . . 4.2400000000000002 111.653 -170.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.588 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -60.22 164.12 15.21 Favored Glycine 0 C--N 1.317 -0.506 0 CA-C-O 121.733 0.629 . . . . 1.1000000000000001 113.685 -176.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.569 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 29.3 t-20 . . . . . 0 C--N 1.312 -1.048 0 CA-C-N 113.835 -1.182 . . . . 1.29 112.212 -176.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . 0.875 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.539 1.577 0 N-CA-C 111.902 -0.479 . . . . 1.2 111.902 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -133.14 -61.27 0.83 Allowed 'General case' 0 C--O 1.227 -0.111 0 C-N-CA 124.325 1.05 . . . . 2.8799999999999999 110.387 -177.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -70.32 -49.44 49.4 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.14 -0.936 . . . . 1.3100000000000001 112.593 -169.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.583 ' HB2' ' CD ' ' A' ' 89' ' ' GLU . 2.8 mm? -66.53 -39.82 88.8 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.084 -0.71 . . . . 1.3300000000000001 109.084 -176.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 1.028 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -52.19 -57.46 9.59 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.51 -1.223 . . . . 0.88 110.44 171.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -69.22 -38.05 78.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 113.905 -1.498 . . . . 1.03 112.276 -172.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 3.9 m-30 -74.77 -24.57 58.71 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.236 -0.438 . . . . 1.6699999999999999 111.084 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . 0.5 ' HA2' ' HE1' ' A' ' 57' ' ' PHE . . . -76.95 -9.84 86.5 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 121.151 -0.547 . . . . 0.78000000000000003 112.937 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.08 -23.66 66.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.962 0.411 . . . . 1.8999999999999999 111.241 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 69.8 m . . . . . 0 C--N 1.328 -0.349 0 CA-C-O 120.838 0.351 . . . . 1.4399999999999999 110.961 -175.146 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 . . . . . 0 N--CA 1.451 -0.388 0 CA-C-O 120.786 0.326 . . . . 2.4199999999999999 111.77 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.518 ' HB3' ' OE2' ' A' ' 42' ' ' GLU . 4.8 m -67.6 -30.41 69.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.399 -0.364 . . . . 1.25 110.732 176.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.483 ' ND2' HD22 ' A' ' 134' ' ' LEU . 0.0 OUTLIER -62.3 -15.31 47.05 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.158 0.504 . . . . 1.78 110.109 -178.436 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.704 HH12 ' HA ' ' A' ' 128' ' ' ALA . 24.6 tpp180 -52.99 -49.94 65.16 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.368 -0.833 . . . . 1.3999999999999999 110.743 174.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.611 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 42.8 mt-10 -52.6 -52.01 57.22 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.366 -1.288 . . . . 0.68000000000000005 111.873 -174.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.58 HD21 HG11 ' A' ' 46' ' ' VAL . 0.4 OUTLIER -46.42 -45.96 18.34 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.163 -0.926 . . . . 1.1599999999999999 110.788 177.656 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.665 HG13 ' HE2' ' A' ' 130' ' ' MET . 70.9 t -68.59 -61.36 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-O 121.253 0.549 . . . . 0.27000000000000002 110.187 178.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 6' ' ' ARG . 63.3 t -51.65 -52.47 21.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 114.917 -1.038 . . . . 0.33000000000000002 112.66 -173.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -58.98 -35.31 72.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.065 -0.516 . . . . 0.58999999999999997 111.105 -176.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.699 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 26.9 t80 -77.35 -38.67 49.79 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 120.561 -0.456 . . . . 1.6100000000000001 111.178 -176.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.811 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.3 mp -59.4 -38.78 81.46 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 119.825 -0.75 . . . . 0.34000000000000002 109.499 175.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.453 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 40.6 t -60.8 -45.67 93.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.369 0.604 . . . . 1.05 110.581 175.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -62.08 -32.56 73.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.275 -0.875 . . . . 1.22 111.037 -178.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.609 ' HA ' ' CE ' ' A' ' 16' ' ' LYS . 4.4 mmpt? -72.46 -43.94 63.02 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 113.102 0.778 . . . . 1.4099999999999999 113.102 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.658 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -64.39 -24.17 67.54 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.76 -0.376 . . . . 1.3500000000000001 111.159 -178.376 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.0 t -58.09 -45.12 87.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.47 . . . . 0.93999999999999995 111.554 -178.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -76.87 0.26 21.51 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.05 0.452 . . . . 1.3700000000000001 111.834 -177.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.0 mmmt -109.98 -28.19 8.85 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.816 0.817 . . . . 2.2000000000000002 109.313 -178.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.82 23.26 9.43 Favored Glycine 0 N--CA 1.442 -0.905 0 CA-C-N 114.087 -1.415 . . . . 0.53000000000000003 111.303 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -116.16 166.78 11.64 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.234 -0.483 . . . . 0.76000000000000001 110.395 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.427 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 5.6 t -110.27 147.61 33.52 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.11 -0.496 . . . . 0.52000000000000002 110.048 179.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.453 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -77.35 -47.3 20.28 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.088 -0.505 . . . . 3.3599999999999999 110.192 177.177 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.5 m -62.16 -36.13 80.92 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.773 0.286 . . . . 1.3700000000000001 111.773 -178.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.427 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 96.6 mt-30 -55.0 -28.0 48.53 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.864 0.364 . . . . 1.1100000000000001 111.908 -178.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.476 ' O ' ' HB2' ' A' ' 124' ' ' SER . 35.9 m-85 -116.6 -14.93 10.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.353 -0.385 . . . . 1.28 111.512 -175.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.58 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 50.8 m -101.37 153.56 19.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.727 0.775 . . . . 1.8100000000000001 112.581 -176.179 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.436 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.2 t70 -125.8 -10.92 6.68 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.116 -1.402 . . . . 2.3100000000000001 109.766 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.806 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.2 m -46.97 -71.26 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.926 -1.488 . . . . 0.92000000000000004 113.1 -166.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.806 ' H ' HG23 ' A' ' 30' ' ' VAL . 8.1 pt-20 -99.32 1.82 44.85 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.203 -0.666 . . . . 2.7400000000000002 109.203 177.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.436 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.7 tt0 . . . . . 0 N--CA 1.448 -0.542 0 CA-C-N 115.078 -0.964 . . . . 1.45 111.457 -175.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.635 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.3 OUTLIER . . . . . 0 CA--C 1.535 0.394 0 N-CA-C 110.035 -0.357 . . . . 1.1200000000000001 110.035 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.64 ' CD ' ' H ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -91.62 -36.74 13.48 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 122.017 0.913 . . . . 2.02 109.515 171.209 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.793 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 75.0 m -69.07 -23.92 64.09 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 113.772 -1.558 . . . . 1.25 114.595 -165.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -56.95 -44.31 82.41 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 119.889 -0.724 . . . . 1.9099999999999999 110.159 179.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.529 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -75.64 -39.71 57.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.017 0.436 . . . . 0.52000000000000002 110.335 175.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.793 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 60.1 t -54.94 -60.38 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.508 -0.769 . . . . 1.4099999999999999 111.671 178.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.611 ' NZ ' ' HB3' ' A' ' 7' ' ' GLU . 15.1 ptpt -60.07 -34.94 74.12 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.273 -0.64 . . . . 0.67000000000000004 109.273 -178.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.579 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 4.7 mm100 -66.6 -32.47 73.83 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.763 -0.653 . . . . 0.98999999999999999 111.054 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.724 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -81.48 -35.67 30.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.351 0.596 . . . . 0.41999999999999998 110.315 176.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.715 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.5 mp -66.56 -22.92 66.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.49 -0.777 . . . . 1.3300000000000001 111.996 -177.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.579 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.3 ptp180 -86.18 -27.94 24.23 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.106 -0.702 . . . . 2.1699999999999999 109.106 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.715 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.1 mm-40 -70.12 -47.93 59.66 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.653 -1.158 . . . . 1.1000000000000001 109.524 174.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.416 ' HB2' ' HD2' ' A' ' 155' ' ' TYR . . . -68.02 -38.88 83.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.447 -0.797 . . . . 0.53000000000000003 110.268 174.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.68 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -61.84 -42.78 99.78 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.51 -0.768 . . . . 0.69999999999999996 112.489 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -54.08 -44.6 71.29 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.883 0.373 . . . . 1.04 111.04 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.415 ' HA ' ' CD2' ' A' ' 59' ' ' LEU . 37.3 mt-10 -63.38 -29.22 70.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.934 -0.575 . . . . 2.29 111.388 178.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.524 ' HZ ' HD12 ' B' 1008 ' ' LEU . 71.3 t80 -77.5 -39.87 44.82 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.207 -0.451 . . . . 2.29 110.294 177.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.68 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.4 mt-10 -62.81 -46.89 85.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.868 -0.605 . . . . 1.3 111.067 -176.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.514 HD12 ' N ' ' A' ' 60' ' ' ARG . 4.5 pp -59.25 -33.08 70.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.215 -0.448 . . . . 1.54 112.028 -175.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.514 ' N ' HD12 ' A' ' 59' ' ' LEU . 5.7 ptp85 -87.34 -35.38 18.42 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.332 -0.547 . . . . 2.5800000000000001 112.353 -174.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.546 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 0.9 OUTLIER -91.63 -5.71 53.42 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 120.732 -0.387 . . . . 5.3200000000000003 111.299 -178.436 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 58' ' ' GLU . 69.2 ttt180 -55.86 -32.5 63.7 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.285 -0.416 . . . . 4.4800000000000004 111.644 -174.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -54.34 -39.35 67.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.837 -0.62 . . . . 4.7199999999999998 111.96 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.409 ' HB1' HD13 ' A' ' 68' ' ' LEU . . . -90.72 -28.83 18.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.549 -0.296 . . . . 1.1699999999999999 111.736 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.672 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 28.0 t80 -51.82 -38.55 56.24 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.86 0.689 . . . . 2.8100000000000001 112.86 -172.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.1 p -72.03 -34.83 69.11 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.859 0.318 . . . . 2.1899999999999999 111.859 -176.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -90.43 -32.21 16.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.914 0.388 . . . . 2.7200000000000002 111.226 -175.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.44 ' HA ' ' HG3' ' A' ' 71' ' ' GLN . 3.6 mp -60.51 -17.35 44.98 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 112.864 0.69 . . . . 1.5600000000000001 112.864 -175.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.528 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 3.0 p -58.9 -35.73 73.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 118.794 0.725 . . . . 0.69999999999999996 110.403 -178.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.1 m -65.93 -28.59 69.04 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.192 -0.913 . . . . 1.3400000000000001 110.437 175.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.44 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 7.6 mt-30 -86.9 -36.16 18.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.341 -0.845 . . . . 1.4199999999999999 110.249 -177.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.565 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.4 mm? -65.39 -32.53 74.2 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 109.077 -0.712 . . . . 1.3700000000000001 109.077 169.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.466 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 32.7 m80 66.11 39.01 4.49 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.292 -1.003 . . . . 2.7200000000000002 108.292 -173.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.656 HG22 ' HE1' ' A' ' 119' ' ' MET . 29.0 mm -45.18 117.34 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 113.634 -1.621 . . . . 0.91000000000000003 112.316 -177.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.762 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.7 -171.34 0.27 Allowed Pre-proline 0 N--CA 1.442 -0.872 0 CA-C-N 114.574 -1.194 . . . . 0.51000000000000001 108.019 -171.078 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.762 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 52.7 Cg_exo -28.62 166.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.364 1.35 0 C-N-CA 125.299 3.999 . . . . 0.46999999999999997 115.628 165.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.46 -30.34 0.01 OUTLIER Glycine 0 N--CA 1.47 0.962 0 N-CA-C 117.449 1.74 . . . . 0.40000000000000002 117.449 -172.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.472 ' HA ' ' CD1' ' A' ' 80' ' ' TYR . 28.2 p -67.07 6.4 0.54 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.942 0.871 . . . . 0.56000000000000005 112.576 -178.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.01 -10.4 57.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.327 0.584 . . . . 0.34000000000000002 110.138 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.472 ' CD1' ' HA ' ' A' ' 78' ' ' THR . 4.9 p90 -73.97 -19.1 60.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.761 -0.654 . . . . 4.1299999999999999 109.835 175.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.598 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 25.9 mt-30 -87.48 -18.27 30.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.763 0.792 . . . . 1.03 110.288 174.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.1 m -75.88 -53.42 8.46 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.663 -1.153 . . . . 0.47999999999999998 108.844 170.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.442 ' CD2' ' HZ3' ' A' ' 129' ' ' TRP . 90.2 t80 -65.66 -15.39 62.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.85 -1.068 . . . . 1.1799999999999999 110.06 174.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.632 ' HA ' HG12 ' A' ' 87' ' ' VAL . 28.7 tt0 -60.78 -49.08 78.91 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 121.773 0.797 . . . . 0.80000000000000004 110.111 176.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.454 ' H ' ' HG2' ' A' ' 85' ' ' GLN . 62.8 mm-40 -50.16 -37.58 35.37 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.731 -1.577 . . . . 1.6200000000000001 112.0 -176.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.571 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 3.6 p -91.62 -42.45 13.67 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 114.633 -1.167 . . . . 1.3 111.799 -176.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.632 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.9 p -59.71 -24.07 28.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 122.077 0.941 . . . . 0.84999999999999998 109.399 176.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.3 m-80 -71.51 -39.78 70.58 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.037 -1.438 . . . . 0.91000000000000003 111.691 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.762 ' HA ' ' HD2' ' A' ' 92' ' ' ARG . 1.6 pp20? -77.9 -32.44 51.76 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.53 0.681 . . . . 2.8700000000000001 109.653 -179.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.619 HD12 HH11 ' A' ' 99' ' ' ARG . 0.2 OUTLIER -61.71 -30.97 71.11 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.214 -1.357 . . . . 1.28 112.008 -165.912 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.409 ' HA ' ' HB ' ' A' ' 95' ' ' VAL . 17.2 p90 -107.41 -30.06 8.89 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.208 0.447 . . . . 2.2999999999999998 112.208 -175.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.762 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -65.27 -22.05 66.8 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.066 0.46 . . . . 5.0599999999999996 111.901 -169.306 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.503 ' N ' ' HD3' ' A' ' 92' ' ' ARG . 28.1 t70 -92.91 -13.86 28.36 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.795 -0.638 . . . . 3.1200000000000001 111.67 -172.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.16 69.78 0.11 Allowed Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 118.862 -1.637 . . . . 2.3100000000000001 112.805 -173.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.562 HG13 ' CD1' ' A' ' 141' ' ' TRP . 0.1 OUTLIER -67.77 109.81 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 122.992 1.377 . . . . 1.0600000000000001 110.499 -173.576 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.422 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 2.8 p30 -108.04 -170.89 1.76 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 113.391 -1.731 . . . . 2.1200000000000001 109.653 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.97 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 15.8 m-90 -54.9 -42.64 72.41 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.571 -0.74 . . . . 3.3399999999999999 110.664 177.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -77.27 -30.32 54.71 Favored Glycine 0 N--CA 1.452 -0.282 0 CA-C-N 115.909 -0.587 . . . . 0.68999999999999995 113.567 -174.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.754 HH12 ' HA ' ' B' 1009 ' ' ALA . 16.5 mmt180 -59.97 -36.61 77.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.314 0.578 . . . . 4.2400000000000002 111.368 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.472 HG12 ' HG ' ' A' ' 138' ' ' LEU . 94.5 mt -78.0 -32.35 17.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.601 -0.727 . . . . 0.44 111.895 -173.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 105' ' ' SER . 1.6 m -65.16 -22.97 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.401 0.619 . . . . 1.3500000000000001 110.197 174.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.75 -42.85 19.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.205 0.526 . . . . 0.44 110.049 175.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.422 ' CE1' HG23 ' A' ' 87' ' ' VAL . 22.5 t80 -54.71 -55.11 33.34 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.891 -1.05 . . . . 1.49 111.358 177.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.715 ' CZ ' ' HB3' ' A' ' 50' ' ' LEU . 0.2 OUTLIER -70.87 -20.56 62.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.014 0.435 . . . . 3.29 110.292 -176.501 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.699 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 33.7 t -73.02 -50.61 22.1 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.927 -0.579 . . . . 1.1899999999999999 110.362 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.461 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 18.2 t80 -70.28 -26.8 63.97 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 116.512 -0.313 . . . . 2.8900000000000001 110.216 -178.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.722 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -70.44 -36.03 68.97 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.215 -0.993 . . . . 0.29999999999999999 111.38 174.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.811 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -69.22 -33.88 74.32 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 110.855 -0.898 . . . . 0.23000000000000001 110.855 173.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.672 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -69.81 -33.61 72.57 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.136 -0.532 . . . . 0.31 110.643 175.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.595 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -59.19 -39.78 83.67 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.253 1.025 . . . . 1.1200000000000001 108.625 -179.723 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.641 ' SG ' HG22 ' A' ' 123' ' ' VAL . 35.6 t -53.0 -53.82 44.4 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 113.622 -1.626 . . . . 0.26000000000000001 110.604 173.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.46 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 93.5 t -65.8 -38.44 82.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.261 -0.427 . . . . 0.34999999999999998 111.07 -178.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.528 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 31.1 mt-10 -56.1 -34.06 65.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.015 0.436 . . . . 2.5099999999999998 110.287 175.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.445 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 45.9 m -74.64 -39.13 62.28 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.412 0.625 . . . . 0.28000000000000003 109.333 178.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 111' ' ' CYS . 91.0 t -66.37 -34.37 69.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.095 -0.957 . . . . 1.23 109.565 -179.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -52.12 -48.89 64.57 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.575 -1.648 . . . . 0.59999999999999998 111.196 178.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.41 ' HB2' ' HG3' ' A' ' 119' ' ' MET . 28.7 mmtt -88.05 12.47 13.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.718 -0.674 . . . . 1.6200000000000001 110.419 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.472 ' HA ' HE21 ' A' ' 120' ' ' GLN . 44.9 mt-10 60.11 46.31 10.78 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.876 0.846 . . . . 1.8799999999999999 110.714 -177.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.656 ' HE1' HG22 ' A' ' 74' ' ' ILE . 27.3 mtm -118.69 45.86 1.96 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.462 -1.244 . . . . 0.31 107.738 178.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.472 HE21 ' HA ' ' A' ' 118' ' ' GLU . 4.5 mt-30 -61.01 -7.28 2.36 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.373 -1.285 . . . . 1.1499999999999999 113.156 -175.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.55 HG23 HD22 ' A' ' 122' ' ' LEU . 28.3 m -66.61 -25.8 35.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 O-C-N 122.025 -0.422 . . . . 0.46000000000000002 111.197 173.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.772 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.4 mm? -71.91 -27.05 62.57 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 110.268 -0.271 . . . . 0.26000000000000001 110.268 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.641 HG22 ' SG ' ' A' ' 111' ' ' CYS . 60.7 t -43.48 -53.6 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 123.777 0.673 . . . . 0.25 112.184 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.58 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 4.8 t -75.11 -34.62 61.73 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.749 -0.38 . . . . 1.3500000000000001 110.542 -179.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.772 ' HD2' HD13 ' A' ' 122' ' ' LEU . 82.4 mtt180 -63.83 -51.6 63.93 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.243 -0.435 . . . . 2.6699999999999999 110.787 -177.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.65 ' O ' ' HB2' ' A' ' 130' ' ' MET . 89.7 mt -54.52 -47.79 70.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.878 -0.601 . . . . 0.23000000000000001 110.663 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.663 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.93 -25.53 57.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.239 -0.437 . . . . 0.28999999999999998 111.962 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.704 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -68.75 -67.03 0.5 Allowed 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 121.117 0.484 . . . . 0.28000000000000003 110.356 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.634 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 37.6 p-90 -75.69 -17.28 60.0 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.318 -0.855 . . . . 3.9100000000000001 111.809 -176.132 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.722 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 0.3 OUTLIER -65.09 -44.68 88.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.428 . . . . 1.0800000000000001 109.977 173.143 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.474 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -72.65 -38.87 67.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.385 -0.371 . . . . 0.25 110.125 176.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.597 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 38.0 m -59.76 -45.25 92.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.064 -0.517 . . . . 0.40000000000000002 111.678 175.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.429 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 0.7 OUTLIER -56.11 -41.24 74.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.807 0.337 . . . . 3.1299999999999999 110.578 177.693 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.788 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.4 tt -62.52 -50.54 70.98 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.864 -0.791 . . . . 0.94999999999999996 108.864 173.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . 0.427 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 5.2 m-80 -51.26 -48.57 62.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.879 -0.6 . . . . 0.46000000000000002 112.398 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -80.99 -50.42 9.72 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.294 0.479 . . . . 0.58999999999999997 112.294 -175.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . 0.429 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 1.7 m80 -90.64 -51.58 5.32 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.656 0.613 . . . . 1.45 112.656 -171.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.788 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -81.47 -46.98 13.76 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.612 0.968 . . . . 1.2 113.612 -168.644 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.768 ' HA ' HD12 ' A' ' 142' ' ' ILE . 34.1 tt0 -44.19 -52.92 14.94 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 113.259 0.837 . . . . 0.75 113.259 -172.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.6 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 38.8 Cg_exo -59.5 -44.23 33.97 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 121.647 1.565 . . . . 0.56000000000000005 111.529 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . 0.562 ' CD1' HG13 ' A' ' 95' ' ' VAL . 1.5 t-105 -63.79 -42.93 97.63 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.48 -0.782 . . . . 1.2 110.203 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.768 HD12 ' HA ' ' A' ' 139' ' ' GLU . 49.5 mt -48.68 -50.25 13.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.053 0.454 . . . . 0.32000000000000001 111.128 173.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.5 mm-40 -59.96 -31.79 70.21 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.521 -0.763 . . . . 0.56999999999999995 111.46 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.2 mm-40 -65.14 -19.42 65.97 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.599 0.714 . . . . 0.78000000000000003 110.733 176.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -111.16 5.14 19.85 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.198 -0.91 . . . . 0.93000000000000005 110.408 -175.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 117.17 -42.26 1.9 Allowed Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.626 -0.715 . . . . 0.56000000000000005 113.071 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . 0.583 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 132.8 -176.2 19.61 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.369 -0.92 . . . . 0.48999999999999999 112.343 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.678 ' HZ2' ' HG3' ' A' ' 139' ' ' GLU . 12.9 m-90 -73.16 -47.24 45.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.046 0.451 . . . . 3.5699999999999998 110.495 -177.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -59.85 -41.42 91.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.654 -0.703 . . . . 1.96 110.494 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.594 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 86.3 m -56.1 -35.22 66.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.924 -0.58 . . . . 0.67000000000000004 111.404 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.97 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 64.4 t80 -61.1 -45.12 96.0 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.875 -0.33 . . . . 3.0 110.202 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.591 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -70.49 -24.6 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.474 0.654 . . . . 1.1499999999999999 109.869 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -66.81 -22.99 66.0 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.276 -0.42 . . . . 1.6699999999999999 110.403 173.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.1 mt -98.03 -55.84 2.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.296 0.57 . . . . 1.3 110.88 178.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . 0.416 ' HD2' ' HB2' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -121.7 27.41 8.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.439 -0.8 . . . . 4.2400000000000002 110.416 -170.712 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.724 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -58.14 167.0 6.21 Favored Glycine 0 CA--C 1.503 -0.709 0 CA-C-O 121.834 0.686 . . . . 1.1000000000000001 114.24 -178.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.715 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 28.5 t-20 . . . . . 0 C--N 1.312 -1.057 0 CA-C-N 113.68 -1.26 . . . . 1.29 111.224 -177.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.405 0 N-CA-C 113.977 0.351 . . . . 1.2 113.977 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . 0.419 ' O ' ' HB3' ' B' 1009 ' ' ALA . 18.4 mmt180 -107.38 -37.04 6.34 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.672 0.619 . . . . 2.8799999999999999 112.672 177.358 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -71.34 -61.6 1.71 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.884 0.698 . . . . 1.3100000000000001 112.884 -165.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.673 ' H ' HD22 ' B' 1008 ' ' LEU . 1.9 mm? -61.86 -41.96 98.47 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.138 -0.689 . . . . 1.3300000000000001 109.138 -177.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 0.754 ' HA ' HH12 ' A' ' 99' ' ' ARG . . . -38.48 -56.87 1.22 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.333 -1.303 . . . . 0.88 111.645 169.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -73.51 -42.58 61.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.535 -1.211 . . . . 1.03 112.005 -174.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -70.86 -20.79 62.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.062 -0.517 . . . . 1.6699999999999999 111.476 -177.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -75.52 -23.39 73.31 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.841 -0.695 . . . . 0.78000000000000003 112.928 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.75 -19.51 62.53 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.988 0.423 . . . . 1.8999999999999999 111.09 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 18.6 m . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 116.335 -0.393 . . . . 1.4399999999999999 111.2 -173.978 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.7 tp60 . . . . . 0 CA--C 1.53 0.176 0 CA-C-O 121.333 0.587 . . . . 2.4199999999999999 110.714 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.5 p -71.12 -12.33 61.44 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.975 -0.557 . . . . 1.25 111.388 -179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.893 ' HA ' HD22 ' A' ' 8' ' ' LEU . 3.4 p30 -66.29 -25.39 66.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.817 -0.628 . . . . 1.78 111.043 176.283 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.641 ' NH1' ' HB ' ' A' ' 30' ' ' VAL . 15.0 tpp85 -55.62 -50.37 70.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.933 -0.576 . . . . 1.3999999999999999 110.618 175.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -59.41 -49.51 77.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.444 -0.798 . . . . 0.68000000000000005 111.007 -176.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.893 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.1 OUTLIER -47.73 -39.45 17.75 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.102 -0.954 . . . . 1.1599999999999999 111.287 176.874 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.3 t -73.13 -62.08 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.122 0.487 . . . . 0.27000000000000002 110.253 176.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 6' ' ' ARG . 86.1 t -49.88 -49.15 21.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.17 -0.923 . . . . 0.33000000000000002 113.092 -176.288 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -53.72 -37.21 63.09 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.797 0.332 . . . . 0.58999999999999997 110.845 -176.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.608 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 21.5 t80 -78.47 -44.2 25.18 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.293 -0.412 . . . . 1.6100000000000001 111.007 -178.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.809 HD22 ' HB2' ' A' ' 127' ' ' ALA . 6.1 mp -58.03 -42.7 85.88 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 120.435 -0.506 . . . . 0.34000000000000002 109.905 177.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.1 t -58.95 -44.91 91.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.79 -0.641 . . . . 1.05 110.594 177.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.438 ' O ' ' HB3' ' A' ' 18' ' ' SER . 61.3 t80 -69.18 -29.61 67.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.971 -0.559 . . . . 1.22 110.844 -178.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.67 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 9.5 mmpt? -74.58 -32.24 62.32 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 120.666 0.27 . . . . 1.4099999999999999 110.879 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.619 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -68.4 -28.17 66.86 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 120.283 -0.567 . . . . 1.3500000000000001 109.626 174.737 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.438 ' HB3' ' O ' ' A' ' 15' ' ' TYR . 45.1 t -62.5 -36.17 81.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.651 -0.704 . . . . 0.93999999999999995 112.06 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -79.07 -0.01 29.71 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.367 0.604 . . . . 1.3700000000000001 111.243 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.609 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 19.9 mmmt -112.97 -28.66 7.63 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.783 0.801 . . . . 2.2000000000000002 109.09 178.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.36 21.1 11.02 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.119 -1.401 . . . . 0.53000000000000003 111.569 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.609 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 94.4 m-85 -110.2 167.24 10.34 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.571 -0.314 . . . . 0.76000000000000001 110.24 178.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.586 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 6.6 t -111.47 149.97 30.56 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.034 0.445 . . . . 0.52000000000000002 110.866 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.588 ' HZ2' ' HG2' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -65.47 -50.4 65.48 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.474 -0.785 . . . . 3.3599999999999999 110.379 173.555 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.9 t -70.42 -24.63 62.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 1.3700000000000001 111.588 -172.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.586 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 92.7 mt-30 -57.7 -32.29 67.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.006 0.432 . . . . 1.1100000000000001 110.997 177.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.512 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 16.4 m-85 -114.76 -16.44 11.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.1 -0.5 . . . . 1.28 111.674 -173.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.608 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 24.8 m -100.97 152.04 21.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.721 0.772 . . . . 1.8100000000000001 112.661 -175.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.476 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 2.7 t70 -127.81 -8.69 5.54 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.244 -1.344 . . . . 2.3100000000000001 109.842 -177.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.819 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.3 m -51.39 -72.88 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.196 -1.365 . . . . 0.92000000000000004 113.041 -169.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.819 ' H ' HG23 ' A' ' 30' ' ' VAL . 1.7 pm0 -100.57 3.04 42.38 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.089 0.471 . . . . 2.7400000000000002 110.337 174.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.476 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 19.7 tt0 . . . . . 0 C--O 1.234 0.239 0 CA-C-N 115.618 -0.719 . . . . 1.45 111.324 178.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.958 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.8 t . . . . . 0 CA--C 1.538 0.514 0 N-CA-C 109.961 -0.385 . . . . 1.1200000000000001 109.961 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.958 ' H ' HG23 ' A' ' 41' ' ' THR . 11.2 pt-20 -94.98 -29.05 14.83 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 122.96 1.362 . . . . 2.02 108.211 164.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.59 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.0 OUTLIER -62.91 -26.3 68.73 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 112.021 -2.354 . . . . 1.25 114.107 -166.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -55.56 -42.23 74.4 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.918 -0.313 . . . . 1.9099999999999999 110.411 -179.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.542 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -79.48 -37.33 37.03 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.97 0.414 . . . . 0.52000000000000002 110.354 176.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.673 ' HA ' ' CG1' ' A' ' 152' ' ' VAL . 99.7 t -58.11 -60.96 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.683 -0.69 . . . . 1.4099999999999999 111.353 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.476 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 10.6 ptpt -59.41 -34.62 72.69 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.365 -0.605 . . . . 0.67000000000000004 109.365 -178.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.531 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 4.7 mm100 -66.59 -32.44 73.78 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.439 -0.801 . . . . 0.98999999999999999 111.01 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.762 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -82.88 -35.02 26.55 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.303 0.573 . . . . 0.41999999999999998 110.3 176.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.451 HD12 ' CE2' ' A' ' 151' ' ' PHE . 1.1 tp -63.06 -31.38 72.51 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.245 -0.889 . . . . 1.3300000000000001 111.468 -177.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.531 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 9.5 ptp180 -79.05 -30.24 43.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.661 0.743 . . . . 2.1699999999999999 109.098 -178.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.647 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.4 mm-40 -68.9 -47.93 64.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.58 -1.191 . . . . 1.1000000000000001 109.799 177.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.2 -36.8 82.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.427 -0.806 . . . . 0.53000000000000003 110.073 174.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.707 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.73 -44.05 98.4 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.46 -0.791 . . . . 0.69999999999999996 112.144 179.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.447 ' O ' HD22 ' A' ' 59' ' ' LEU . 23.9 t70 -55.2 -39.65 69.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.785 0.326 . . . . 1.04 110.774 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.41 ' O ' HD21 ' A' ' 59' ' ' LEU . 57.3 mm-40 -65.38 -26.45 68.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.36 -0.836 . . . . 2.29 111.658 178.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -82.84 -33.51 27.09 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.516 -0.311 . . . . 2.29 111.205 175.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.772 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 38.2 mt-10 -69.4 -53.37 19.76 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 112.374 0.509 . . . . 1.3 112.374 -165.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.533 HD23 ' N ' ' A' ' 59' ' ' LEU . 2.3 pt? -52.31 -35.18 49.99 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 123.608 0.568 . . . . 1.54 110.477 -177.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 75.7 mtt180 -61.4 -58.86 6.48 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.424 -0.807 . . . . 2.5800000000000001 112.055 -178.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.772 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 8.9 p90 -91.32 -6.57 52.9 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.028 0.381 . . . . 5.3200000000000003 112.028 -173.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 58' ' ' GLU . 17.7 tpp85 -62.84 -30.77 71.75 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.95 0.352 . . . . 4.4800000000000004 111.95 -171.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -65.16 -39.88 93.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.907 0.384 . . . . 4.7199999999999998 110.196 178.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.432 ' HB1' ' CD1' ' A' ' 68' ' ' LEU . . . -77.21 -41.27 41.98 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.025 -0.534 . . . . 1.1699999999999999 110.858 176.563 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.683 ' CZ ' ' HB1' ' A' ' 109' ' ' ALA . 39.4 t80 -43.42 -47.94 7.06 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.959 0.725 . . . . 2.8100000000000001 112.959 -174.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.3 p -60.01 -37.17 78.95 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.785 0.326 . . . . 2.1899999999999999 111.627 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -86.49 -29.62 22.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.311 0.576 . . . . 2.7200000000000002 110.642 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.432 ' CD1' ' HB1' ' A' ' 64' ' ' ALA . 2.0 mp -59.73 -16.87 30.44 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.27 -0.877 . . . . 1.5600000000000001 112.596 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.487 HG22 HG13 ' A' ' 74' ' ' ILE . 2.2 p -57.88 -27.81 63.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.839 0.291 . . . . 0.69999999999999996 111.686 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -71.99 -33.75 68.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.652 0.739 . . . . 1.3400000000000001 109.327 174.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -77.03 -38.39 52.97 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.123 -0.944 . . . . 1.4199999999999999 110.036 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.708 HD21 ' HZ ' ' A' ' 106' ' ' PHE . 3.1 mm? -65.87 -32.87 74.63 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.559 -0.292 . . . . 1.3700000000000001 110.514 172.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 59.7 m80 63.25 41.08 8.17 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.332 -0.988 . . . . 2.7200000000000002 108.332 -172.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.644 HG22 ' HE1' ' A' ' 119' ' ' MET . 31.5 mm -46.71 115.22 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 113.975 -1.466 . . . . 0.91000000000000003 112.057 -177.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.725 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.15 -174.83 0.45 Allowed Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 114.746 -1.115 . . . . 0.51000000000000001 108.117 -168.234 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.725 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 23.4 Cg_exo -30.3 166.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 125.166 3.911 . . . . 0.46999999999999997 115.001 165.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.595 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -28.82 -34.01 0.01 OUTLIER Glycine 0 N--CA 1.469 0.895 0 N-CA-C 116.931 1.532 . . . . 0.40000000000000002 116.931 -170.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.448 ' N ' ' O ' ' A' ' 76' ' ' PRO . 22.2 p -62.32 3.87 0.17 Allowed 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.893 0.701 . . . . 0.56000000000000005 112.893 -179.383 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.54 -13.16 62.19 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.207 0.527 . . . . 0.34000000000000002 109.927 172.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.595 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 10.5 p90 -75.91 -18.29 59.44 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.526 -0.546 . . . . 4.1299999999999999 109.526 174.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.462 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 24.2 mt-30 -77.57 -32.55 53.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.878 0.847 . . . . 1.03 109.135 172.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.9 m -68.37 -52.28 34.89 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.283 -1.326 . . . . 0.47999999999999998 109.797 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -68.99 -17.97 63.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.046 -0.979 . . . . 1.1799999999999999 110.349 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.57 ' HA ' HG12 ' A' ' 87' ' ' VAL . 44.3 tt0 -64.47 -48.78 73.97 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.02 -0.536 . . . . 0.80000000000000004 110.502 177.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -46.48 -35.45 5.67 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.715 -1.13 . . . . 1.6200000000000001 110.302 176.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.742 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.4 t -81.47 -54.82 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.018 0 CA-C-N 114.455 -1.248 . . . . 1.3 111.069 -176.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.57 HG12 ' HA ' ' A' ' 84' ' ' GLU . 10.6 p -58.11 -26.39 29.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.591 0.71 . . . . 0.84999999999999998 109.567 -178.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.489 ' O ' ' HB3' ' A' ' 92' ' ' ARG . 2.3 m-80 -68.07 -40.87 82.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.521 -1.218 . . . . 0.91000000000000003 111.833 175.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.951 ' HG2' ' HA2' ' B' 1005 ' ' GLY . 0.3 OUTLIER -79.41 -33.54 42.59 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-O 121.691 0.758 . . . . 2.8700000000000001 109.756 179.259 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.697 ' HA ' ' NH1' ' A' ' 99' ' ' ARG . 42.3 mt -68.31 -22.22 64.72 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 114.392 -1.277 . . . . 1.28 112.146 -168.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.556 ' HD1' ' O ' ' A' ' 87' ' ' VAL . 6.2 p90 -108.75 -24.76 11.16 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.719 -0.392 . . . . 2.2999999999999998 111.93 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.639 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -68.45 -25.69 65.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.823 0.344 . . . . 5.0599999999999996 111.685 -171.719 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.435 ' HB2' ' NE ' ' A' ' 92' ' ' ARG . 26.8 t70 -97.61 -1.27 44.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.198 -0.456 . . . . 3.1200000000000001 111.945 -170.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.03 67.86 0.11 Allowed Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 118.847 -1.644 . . . . 2.3100000000000001 113.335 -176.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.594 HG13 ' CD1' ' A' ' 141' ' ' TRP . 0.2 OUTLIER -70.54 100.61 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 123.045 1.402 . . . . 1.0600000000000001 110.85 -177.485 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.51 ' H ' ' ND2' ' A' ' 96' ' ' ASN . 0.2 OUTLIER -110.19 -171.53 1.85 Allowed 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 113.124 -1.853 . . . . 2.1200000000000001 108.782 172.108 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.691 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 16.0 m-90 -46.09 -52.37 12.17 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.732 0.645 . . . . 3.3399999999999999 110.964 178.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -65.43 -28.14 73.26 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.362 -0.835 . . . . 0.68999999999999995 114.414 -175.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.747 HH12 ' HA ' ' B' 1009 ' ' ALA . 12.7 mmt180 -72.22 -38.0 69.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.156 0.478 . . . . 4.2400000000000002 111.176 -175.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.555 HG12 ' HG ' ' A' ' 138' ' ' LEU . 94.1 mt -70.29 -33.06 52.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.725 -0.67 . . . . 0.44 110.404 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 97' ' ' TRP . 47.0 t -56.31 -54.59 26.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.356 -0.838 . . . . 1.3500000000000001 109.935 170.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -51.1 -47.58 61.9 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.774 -0.648 . . . . 0.44 111.013 176.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.539 ' HA ' HD13 ' A' ' 90' ' ' LEU . 11.3 t80 -55.3 -53.1 60.43 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.939 -1.028 . . . . 1.49 111.993 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.569 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.2 OUTLIER -76.6 -21.85 55.02 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.794 -0.362 . . . . 3.29 110.685 -175.033 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.608 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 47.1 t -70.08 -54.66 12.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 1.1899999999999999 110.615 177.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.708 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 41.9 t80 -64.31 -26.6 68.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.039 0.447 . . . . 2.8900000000000001 109.873 178.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.499 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -69.72 -46.96 51.44 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.809 -0.632 . . . . 0.29999999999999999 112.653 178.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.804 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -60.42 -33.46 81.23 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.36 -0.924 . . . . 0.23000000000000001 110.942 175.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.683 ' HB1' ' CZ ' ' A' ' 65' ' ' PHE . . . -72.11 -30.46 65.09 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.023 -0.589 . . . . 0.31 111.01 176.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.7 -42.42 99.63 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.731 -0.84 . . . . 1.1200000000000001 108.731 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.645 ' SG ' HG13 ' A' ' 123' ' ' VAL . 32.9 t -50.32 -53.22 30.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.915 -1.493 . . . . 0.26000000000000001 110.933 174.054 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.47 HG11 ' HD3' ' A' ' 20' ' ' LYS . 53.1 t -62.52 -44.64 99.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.884 -0.598 . . . . 0.34999999999999998 111.962 -176.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.537 ' HB3' HG21 ' A' ' 74' ' ' ILE . 21.2 mm-40 -60.79 -26.04 66.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.929 0.395 . . . . 2.5099999999999998 111.381 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.501 ' HB3' ' HB2' ' A' ' 122' ' ' LEU . 23.7 m -73.35 -38.51 65.72 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.617 -0.883 . . . . 0.28000000000000003 108.617 174.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 111' ' ' CYS . 88.2 t -68.73 -37.36 77.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.257 -0.883 . . . . 1.23 109.479 -178.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -55.78 -51.02 68.84 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 113.531 -1.668 . . . . 0.59999999999999998 111.516 -177.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' A' ' 113' ' ' GLU . 15.0 mmtt -85.79 15.89 4.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.937 -0.574 . . . . 1.6200000000000001 110.071 -178.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.527 ' HA ' HE21 ' A' ' 120' ' ' GLN . 38.4 mt-10 65.19 48.32 2.22 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.524 -0.762 . . . . 1.8799999999999999 110.832 178.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.644 ' HE1' HG22 ' A' ' 74' ' ' ILE . 25.5 mtm -128.15 43.36 3.15 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.044 -1.095 . . . . 0.31 108.044 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.613 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 1.6 mt-30 -61.47 -7.69 3.4 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.976 -1.011 . . . . 1.1499999999999999 113.131 -175.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.55 HG23 HD22 ' A' ' 122' ' ' LEU . 25.6 m -66.5 -24.78 33.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 122.042 -0.411 . . . . 0.46000000000000002 111.079 174.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.643 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -71.7 -27.02 62.74 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 116.537 -0.301 . . . . 0.26000000000000001 110.19 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.645 HG13 ' SG ' ' A' ' 111' ' ' CYS . 65.5 t -45.97 -54.03 2.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 123.735 0.647 . . . . 0.25 112.116 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.608 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 3.4 t -74.95 -26.02 59.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.901 0.381 . . . . 1.3500000000000001 110.491 -177.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.643 ' HD2' HD13 ' A' ' 122' ' ' LEU . 91.4 mtt180 -71.5 -53.15 14.85 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.337 -0.392 . . . . 2.6699999999999999 110.002 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.528 HD12 ' HA ' ' A' ' 111' ' ' CYS . 76.2 mt -54.46 -50.39 58.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.594 -0.73 . . . . 0.23000000000000001 111.532 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.809 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -57.13 -37.07 71.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.871 0.367 . . . . 0.28999999999999998 110.967 179.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -61.52 -56.96 14.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.701 0.762 . . . . 0.28000000000000003 110.241 175.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.534 ' CZ2' ' HB3' ' A' ' 125' ' ' ARG . 36.4 m0 -56.79 -46.51 81.49 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.148 -1.387 . . . . 3.9100000000000001 110.754 -178.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.574 ' SD ' HD11 ' A' ' 13' ' ' LEU . 88.6 mtp -59.36 -54.07 51.0 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.985 -0.552 . . . . 1.0800000000000001 111.459 -177.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.78 -34.24 75.52 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.044 -0.526 . . . . 0.25 110.318 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 54.9 m -65.81 -48.82 70.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.186 -0.461 . . . . 0.40000000000000002 111.004 175.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.493 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 6.5 m-85 -54.56 -42.58 71.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.438 -0.346 . . . . 3.1299999999999999 110.471 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.801 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.7 tt -61.59 -50.53 72.21 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 109.029 -0.73 . . . . 0.94999999999999996 109.029 173.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -50.51 -56.44 11.61 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.247 0.462 . . . . 0.46000000000000002 112.247 179.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.49 -48.23 15.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.069 0.461 . . . . 0.58999999999999997 111.866 -171.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . 0.493 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 52.4 m-70 -90.49 -51.49 5.38 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 112.7 0.63 . . . . 1.45 112.7 -170.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.801 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -86.07 -42.59 13.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 114.552 1.315 . . . . 1.2 114.552 -165.716 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.654 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 27.5 tt0 -43.85 -51.8 16.38 Favored Pre-proline 0 N--CA 1.47 0.539 0 N-CA-C 112.797 0.666 . . . . 0.75 112.797 -173.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.582 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 47.6 Cg_exo -55.08 -46.06 36.01 Favored 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 121.901 1.734 . . . . 0.56000000000000005 111.824 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . 0.594 ' CD1' HG13 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -61.39 -41.02 96.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.581 -0.736 . . . . 1.2 110.802 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.475 HD12 ' HA ' ' A' ' 139' ' ' GLU . 3.5 mt -54.55 -47.64 71.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.103 0.478 . . . . 0.32000000000000001 110.628 174.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.654 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 67.0 mm-40 -58.24 -34.19 70.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.415 -0.811 . . . . 0.56999999999999995 110.916 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.4 mm-40 -65.19 -23.17 67.02 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 121.46 0.647 . . . . 0.78000000000000003 110.892 178.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.627 ' N ' HD22 ' A' ' 145' ' ' ASN . 0.7 OUTLIER -102.12 2.74 37.8 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.164 -0.926 . . . . 0.93000000000000005 109.315 -174.656 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.6 -44.14 1.53 Allowed Glycine 0 N--CA 1.439 -1.1 0 CA-C-N 114.813 -1.085 . . . . 0.56000000000000005 112.436 177.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 138.66 175.78 14.18 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.728 -0.749 . . . . 0.48999999999999999 111.911 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.408 ' HB3' HG11 ' A' ' 46' ' ' VAL . 5.5 m-90 -68.27 -43.93 76.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.776 0.322 . . . . 3.5699999999999998 110.697 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.419 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 23.4 t70 -63.11 -39.65 95.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.115 -0.493 . . . . 1.96 109.908 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.548 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 94.1 m -56.25 -36.67 68.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.605 -0.725 . . . . 0.67000000000000004 111.069 177.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.691 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 75.1 t80 -59.98 -42.97 95.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.837 0.351 . . . . 3.0 110.277 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.673 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.1 m -73.4 -24.75 20.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.408 0.623 . . . . 1.1499999999999999 110.05 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 8.2 mm-40 -64.49 -23.63 67.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.016 0.436 . . . . 1.6699999999999999 109.908 173.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 150' ' ' THR . 1.9 mt -98.52 -53.46 3.32 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.964 -0.562 . . . . 1.3 110.768 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -120.79 26.44 9.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.684 -0.689 . . . . 4.2400000000000002 111.436 -170.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.762 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -57.83 160.2 11.92 Favored Glycine 0 N--CA 1.448 -0.527 0 CA-C-N 116.102 -0.499 . . . . 1.1000000000000001 113.638 -177.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.647 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 28.7 t-20 . . . . . 0 C--N 1.314 -0.972 0 CA-C-N 113.691 -1.254 . . . . 1.29 112.317 -177.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . 0.951 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.534 1.252 0 N-CA-C 114.512 0.565 . . . . 1.2 114.512 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -98.87 -27.21 14.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 117.537 0.668 . . . . 2.8799999999999999 112.171 173.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . 0.43 ' O ' ' HD2' ' B' 1011 ' ' PHE . . . -91.96 -65.44 1.01 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.235 0.457 . . . . 1.3100000000000001 112.235 -169.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.603 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 18.2 mt -66.5 -35.91 81.44 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.946 -0.761 . . . . 1.3300000000000001 108.946 -176.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 0.747 ' HA ' HH12 ' A' ' 99' ' ' ARG . . . -42.25 -58.62 2.1 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.681 -1.145 . . . . 0.88 111.351 165.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -72.07 -40.21 68.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.136 -0.938 . . . . 1.03 111.789 -175.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . 0.43 ' HD2' ' O ' ' B' 1007 ' ' ALA . 36.9 m-85 -67.65 -24.49 65.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.111 0.481 . . . . 1.6699999999999999 110.397 177.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -79.64 -5.1 89.46 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.681 -0.69 . . . . 0.78000000000000003 112.456 178.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 20.8 t70 -74.85 -22.0 58.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.428 0.632 . . . . 1.8999999999999999 109.685 175.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 28.3 m . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 115.571 -0.74 . . . . 1.4399999999999999 112.33 -173.215 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 37.8 tp60 . . . . . 0 CA--C 1.535 0.393 0 CA-C-O 120.83 0.348 . . . . 2.4199999999999999 111.619 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.417 ' OG ' ' HB3' ' A' ' 43' ' ' SER . 11.7 t -70.63 -15.2 62.71 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.068 0.461 . . . . 1.25 110.563 176.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.818 ' HA ' HD22 ' A' ' 8' ' ' LEU . 7.2 p30 -56.88 -20.83 25.3 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.269 -0.423 . . . . 1.78 111.226 176.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.515 ' O ' HG23 ' A' ' 10' ' ' VAL . 6.8 tpp180 -59.49 -56.2 25.03 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.971 -0.559 . . . . 1.3999999999999999 110.393 174.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.425 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 42.5 mt-10 -57.01 -48.1 79.29 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 115.117 -0.947 . . . . 0.68000000000000005 110.968 -178.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.818 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.1 OUTLIER -49.17 -31.64 8.76 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.933 -1.031 . . . . 1.1599999999999999 111.592 178.75 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.535 HG21 ' N ' ' A' ' 131' ' ' ALA . 78.3 t -81.04 -63.01 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-O 121.555 0.693 . . . . 0.27000000000000002 109.897 172.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 6' ' ' ARG . 55.2 t -54.18 -46.93 67.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.565 -1.198 . . . . 0.33000000000000002 113.066 -171.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -56.17 -38.99 71.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.66 0.267 . . . . 0.58999999999999997 110.979 -177.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.714 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 14.7 t80 -71.96 -42.19 66.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.302 -0.408 . . . . 1.6100000000000001 110.217 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 1.025 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.5 mp -60.53 -41.18 93.92 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 120.499 -0.48 . . . . 0.34000000000000002 109.952 176.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.496 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 23.0 t -61.2 -47.39 86.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 1.05 110.489 178.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -62.4 -30.95 71.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.78 -0.646 . . . . 1.22 110.738 177.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.711 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.4 OUTLIER -81.24 -33.83 32.55 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-N 116.109 -0.496 . . . . 1.4099999999999999 112.276 -173.815 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.586 ' O ' ' HD3' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -62.23 -27.73 69.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.371 0.605 . . . . 1.3500000000000001 110.024 174.509 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.4 t -71.39 -16.25 62.4 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.627 -0.715 . . . . 0.93999999999999995 111.56 -176.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.711 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 19.7 pt20 -79.19 -12.76 59.97 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.356 0.598 . . . . 1.3700000000000001 111.506 -176.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.777 ' NZ ' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -115.51 -20.05 10.37 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 122.197 0.999 . . . . 2.2000000000000002 109.412 179.415 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.28 28.97 5.59 Favored Glycine 0 C--N 1.306 -1.101 0 CA-C-N 113.696 -1.593 . . . . 0.53000000000000003 112.931 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -112.77 168.41 9.7 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.724 0.297 . . . . 0.76000000000000001 111.06 169.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.491 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 5.6 t -110.57 152.31 26.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.341 -0.391 . . . . 0.52000000000000002 110.743 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.496 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.5 OUTLIER -75.19 -46.7 32.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.972 -0.558 . . . . 3.3599999999999999 110.279 173.094 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.428 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 13.2 p -65.85 -25.34 67.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.358 -0.383 . . . . 1.3700000000000001 111.5 -173.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.491 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 97.3 mt-30 -63.43 -30.29 71.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.931 0.396 . . . . 1.1100000000000001 111.051 176.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -121.85 18.51 11.01 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.052 -0.522 . . . . 1.28 111.777 -173.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.428 ' OG ' ' HA ' ' A' ' 25' ' ' SER . 93.3 p -101.02 -178.68 3.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.912 0.863 . . . . 1.8100000000000001 113.156 -171.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.496 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.3 t70 -165.34 -25.52 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.586 -1.643 . . . . 2.3100000000000001 108.43 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.899 HG23 ' H ' ' A' ' 31' ' ' GLU . 15.2 m -55.29 -72.12 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 114.1 -1.409 . . . . 0.92000000000000004 113.014 -174.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.899 ' H ' HG23 ' A' ' 30' ' ' VAL . 34.8 mt-10 -90.17 0.03 57.38 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.759 0.79 . . . . 2.7400000000000002 108.873 177.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 30.8 tt0 . . . . . 0 N--CA 1.443 -0.785 0 CA-C-N 114.53 -1.214 . . . . 1.45 110.453 -178.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.737 HG23 ' OE2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.514 0 N-CA-C 110.147 -0.316 . . . . 1.1200000000000001 110.147 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.737 ' OE2' HG23 ' A' ' 41' ' ' THR . 0.0 OUTLIER -94.18 -32.85 13.54 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.806 0.812 . . . . 2.02 109.814 170.222 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.801 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 5.4 p -56.63 -36.29 69.3 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 113.94 -1.482 . . . . 1.25 113.613 -171.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -46.14 -43.65 15.14 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 123.311 0.382 . . . . 1.9099999999999999 111.894 -173.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.431 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -83.42 -36.86 23.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.777 0.322 . . . . 0.52000000000000002 110.482 176.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.682 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 79.0 t -54.91 -66.58 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 CA-C-N 115.753 -0.658 . . . . 1.4099999999999999 111.174 177.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.801 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.8 ptpt -58.26 -37.99 76.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.783 -0.644 . . . . 0.67000000000000004 110.353 -177.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.73 HE21 ' ND2' ' A' ' 157' ' ' ASN . 7.2 mm100 -63.84 -26.38 68.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.645 -0.707 . . . . 0.98999999999999999 111.402 175.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.57 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -84.97 -32.03 23.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.437 0.637 . . . . 0.41999999999999998 109.819 177.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 9.8 mt -67.91 -21.46 65.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.054 -0.976 . . . . 1.3300000000000001 111.216 -175.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.592 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 13.0 ptp180 -89.73 -35.31 15.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.574 0.702 . . . . 2.1699999999999999 109.485 -178.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.743 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.0 mm-40 -67.65 -46.13 73.32 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.789 -1.096 . . . . 1.1000000000000001 109.396 175.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -71.44 -33.19 69.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.416 -0.811 . . . . 0.53000000000000003 110.325 176.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.644 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -63.26 -43.63 98.21 Favored Glycine 0 CA--C 1.507 -0.463 0 CA-C-N 115.896 -0.593 . . . . 0.69999999999999996 111.759 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.58 ' O ' HD22 ' A' ' 59' ' ' LEU . 28.5 t70 -56.54 -34.74 67.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.873 0.368 . . . . 1.04 110.735 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -68.28 -26.85 65.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.288 -0.869 . . . . 2.29 111.72 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -83.25 -39.19 21.2 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.117 -0.492 . . . . 2.29 111.352 176.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.763 ' HA ' ' CE2' ' A' ' 61' ' ' TYR . 43.6 mt-10 -66.97 -53.39 32.08 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 112.892 0.701 . . . . 1.3 112.892 -166.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.58 HD22 ' O ' ' A' ' 55' ' ' ASP . 2.3 pt? -51.31 -35.04 35.99 Favored 'General case' 0 C--N 1.32 -0.676 0 O-C-N 123.787 0.68 . . . . 1.54 111.021 -172.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 79.8 mtt-85 -64.82 -52.35 57.23 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.213 -0.903 . . . . 2.5800000000000001 111.621 -178.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.763 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 16.4 p90 -91.62 -14.43 30.2 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.082 0.401 . . . . 5.3200000000000003 112.082 -174.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -60.06 -17.29 38.32 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.029 0.381 . . . . 4.4800000000000004 112.029 -170.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -61.54 -36.64 81.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.016 0.436 . . . . 4.7199999999999998 110.72 177.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.619 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -91.43 -24.1 19.82 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.018 0.377 . . . . 1.1699999999999999 112.018 -179.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.535 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 55.0 t80 -40.99 -52.97 3.07 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.621 0.971 . . . . 2.8100000000000001 113.621 -171.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.0 t -69.09 -23.4 64.0 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.904 0.383 . . . . 2.1899999999999999 111.25 -172.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -89.97 -28.56 19.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.307 -0.406 . . . . 2.7200000000000002 111.14 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 48.6 mt -70.69 -18.49 62.82 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 112.455 0.539 . . . . 1.5600000000000001 112.455 -173.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.499 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 2.1 p -55.21 -37.21 66.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.095 0.474 . . . . 0.69999999999999996 111.189 -178.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 28.2 t -61.42 -35.47 77.64 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.599 -0.728 . . . . 1.3400000000000001 109.983 175.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -80.6 -35.44 34.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.336 -0.847 . . . . 1.4199999999999999 110.616 -177.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.521 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.4 mm? -65.61 -33.12 75.17 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.784 -0.45 . . . . 1.3700000000000001 109.784 172.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.477 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 57.6 m-70 67.81 42.63 1.91 Allowed 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 108.254 -1.017 . . . . 2.7200000000000002 108.254 -172.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.521 HG12 ' HB2' ' A' ' 72' ' ' LEU . 28.4 mm -53.32 114.95 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 114.039 -1.437 . . . . 0.91000000000000003 111.114 179.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.783 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.76 -168.72 0.21 Allowed Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 107.369 -1.345 . . . . 0.51000000000000001 107.369 -171.504 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.783 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 71.6 Cg_exo -28.96 165.79 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.507 3.471 . . . . 0.46999999999999997 115.183 163.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.61 -26.54 0.0 OUTLIER Glycine 0 N--CA 1.475 1.291 0 N-CA-C 118.258 2.063 . . . . 0.40000000000000002 118.258 -171.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.47 ' N ' ' O ' ' A' ' 76' ' ' PRO . 45.4 p -69.29 6.49 0.99 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.493 1.146 . . . . 0.56000000000000005 112.125 -179.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.406 ' HA ' ' OG ' ' A' ' 82' ' ' SER . . . -71.93 -12.48 61.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.286 0.565 . . . . 0.34000000000000002 110.237 173.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -77.52 -19.75 55.3 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.261 -0.644 . . . . 4.1299999999999999 109.261 175.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.467 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 30.3 mt-30 -84.39 -20.8 31.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.867 0.841 . . . . 1.03 109.687 173.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.406 ' OG ' ' HA ' ' A' ' 79' ' ' ALA . 3.0 m -74.42 -51.6 14.49 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 114.502 -1.226 . . . . 0.47999999999999998 109.094 170.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.424 ' HA ' HG23 ' A' ' 86' ' ' VAL . 66.6 t80 -66.27 -17.91 65.03 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.991 -1.004 . . . . 1.1799999999999999 110.149 175.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.525 ' HA ' HG12 ' A' ' 87' ' ' VAL . 32.1 tt0 -59.47 -51.31 70.4 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-O 121.624 0.726 . . . . 0.80000000000000004 109.869 178.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.481 ' HG2' ' H ' ' A' ' 85' ' ' GLN . 55.4 mm-40 -48.22 -32.64 7.42 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 113.456 -1.702 . . . . 1.6200000000000001 110.706 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.607 ' HA ' ' HG3' ' A' ' 89' ' ' GLU . 0.8 OUTLIER -89.06 -51.36 12.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 113.961 -1.472 . . . . 1.3 111.25 -175.413 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.525 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.9 p -60.96 -22.17 26.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-O 121.824 0.821 . . . . 0.84999999999999998 109.372 -177.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.456 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 5.1 m-80 -77.45 -36.91 52.52 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 113.982 -1.463 . . . . 0.91000000000000003 111.858 175.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.973 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.0 OUTLIER -83.91 -17.34 41.08 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 121.951 0.882 . . . . 2.8700000000000001 110.284 179.88 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.686 ' HG ' HH11 ' A' ' 99' ' ' ARG . 0.0 OUTLIER -75.43 -50.74 14.9 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 114.98 -1.009 . . . . 1.28 110.525 -179.483 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.456 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 4.4 p90 -88.36 -23.71 23.31 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.204 0.816 . . . . 2.2999999999999998 113.204 -166.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.685 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -58.19 -39.55 79.24 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.454 0.909 . . . . 5.0599999999999996 113.454 -165.23 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -110.08 22.94 14.97 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 115.113 1.523 . . . . 3.1200000000000001 115.113 -167.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 134.41 73.63 0.08 OUTLIER Glycine 0 C--N 1.318 -0.462 0 C-N-CA 117.457 -2.306 . . . . 2.3100000000000001 115.303 -176.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.641 HG22 HH21 ' A' ' 99' ' ' ARG . 89.0 t -71.72 102.69 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.79 0.805 . . . . 1.0600000000000001 111.56 178.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -112.01 -174.87 2.55 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.784 -1.098 . . . . 2.1200000000000001 109.531 -179.021 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.605 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 18.7 m-90 -59.8 -60.64 3.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.111 0.481 . . . . 3.3399999999999999 110.643 178.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.553 ' O ' ' HB ' ' A' ' 101' ' ' VAL . . . -66.66 -25.84 72.9 Favored Glycine 0 C--N 1.33 0.211 0 CA-C-N 115.647 -0.706 . . . . 0.68999999999999995 112.544 -176.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.686 HH11 ' HG ' ' A' ' 90' ' ' LEU . 1.1 tmm_? -64.67 -39.87 94.43 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.475 -0.565 . . . . 4.2400000000000002 109.475 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.606 HG22 ' CE2' ' A' ' 104' ' ' PHE . 82.9 mt -69.86 -33.14 54.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.266 -0.425 . . . . 0.44 110.406 178.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.553 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 91.6 t -51.46 -57.14 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-N 116.002 -0.545 . . . . 1.3500000000000001 110.44 170.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -47.76 -41.84 24.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.012 -0.994 . . . . 0.44 111.52 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.468 ' HB3' ' O ' ' A' ' 100' ' ' ILE . 27.5 t80 -60.29 -43.1 96.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.999 -1.001 . . . . 1.49 110.934 178.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.606 ' CE2' HG22 ' A' ' 100' ' ' ILE . 37.4 m-85 -68.41 -37.64 80.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.325 . . . . 3.29 110.565 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.714 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 16.2 m -61.82 -54.88 36.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.861 -0.609 . . . . 1.1899999999999999 111.071 -176.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -72.56 -31.04 64.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.823 0.344 . . . . 2.8900000000000001 110.281 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.655 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -66.79 -43.73 90.98 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.87 -0.681 . . . . 0.29999999999999999 111.81 177.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 1.025 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.85 -29.02 73.39 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.686 -0.769 . . . . 0.23000000000000001 111.189 175.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.535 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -72.7 -34.14 66.93 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.402 -0.399 . . . . 0.31 110.244 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.523 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.3 OUTLIER -65.57 -34.64 78.72 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.933 0.873 . . . . 1.1200000000000001 109.996 -179.072 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.68 ' O ' HG23 ' A' ' 115' ' ' VAL . 43.0 t -51.89 -50.04 61.83 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.268 -1.333 . . . . 0.26000000000000001 109.369 171.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.777 HG13 ' NZ ' ' A' ' 20' ' ' LYS . 97.1 t -64.9 -36.24 77.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 116.268 -0.424 . . . . 0.34999999999999998 110.527 176.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.523 ' OE2' ' HA ' ' A' ' 110' ' ' LEU . 37.5 mt-10 -54.65 -37.63 65.93 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.073 0.463 . . . . 2.5099999999999998 110.341 175.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 21.1 m -78.85 -38.79 37.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.983 -0.553 . . . . 0.28000000000000003 109.995 -178.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.68 HG23 ' O ' ' A' ' 111' ' ' CYS . 93.6 t -68.53 -33.26 59.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.716 0.77 . . . . 1.23 109.197 -177.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -55.67 -50.13 71.08 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 113.757 -1.565 . . . . 0.59999999999999998 111.575 -178.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -87.5 13.48 10.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.932 -0.576 . . . . 1.6200000000000001 110.211 -178.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.649 ' HA ' HE21 ' A' ' 120' ' ' GLN . 20.9 mm-40 63.88 52.02 2.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.821 0.819 . . . . 1.8799999999999999 111.502 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.59 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 25.9 mtm -130.64 48.37 2.42 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.751 -1.203 . . . . 0.31 107.751 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.649 HE21 ' HA ' ' A' ' 118' ' ' GLU . 4.7 mp0 -64.17 -8.26 11.75 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 114.756 -1.111 . . . . 1.1499999999999999 112.4 -173.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.581 HG23 HD22 ' A' ' 122' ' ' LEU . 28.2 m -64.62 -19.66 25.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.808 0.337 . . . . 0.46000000000000002 111.575 176.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.617 HD13 ' HD3' ' A' ' 125' ' ' ARG . 3.1 mm? -79.81 -24.29 41.5 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.468 -0.333 . . . . 0.26000000000000001 110.146 178.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.662 HG13 ' SG ' ' A' ' 111' ' ' CYS . 56.7 t -46.93 -56.72 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 O-C-N 123.658 0.599 . . . . 0.25 111.849 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.415 ' OG ' HG13 ' A' ' 30' ' ' VAL . 6.6 t -71.1 -29.84 65.79 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.712 -0.395 . . . . 1.3500000000000001 110.275 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.617 ' HD3' HD13 ' A' ' 122' ' ' LEU . 17.2 mtp180 -65.1 -58.51 5.85 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 116.283 -0.417 . . . . 2.6699999999999999 110.857 178.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 122' ' ' LEU . 79.2 mt -49.93 -49.9 20.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.58 -0.737 . . . . 0.23000000000000001 110.565 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.666 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -59.04 -36.49 75.11 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.727 0.299 . . . . 0.28999999999999998 111.528 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.26 -56.69 11.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.504 0.668 . . . . 0.28000000000000003 110.936 177.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.486 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 94.3 m95 -64.47 -35.0 79.53 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.809 -1.087 . . . . 3.9100000000000001 111.182 -176.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.655 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 1.2 mmm -63.87 -50.5 68.58 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.073 0.463 . . . . 1.0800000000000001 110.824 177.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.535 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -63.48 -34.81 78.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.859 -0.61 . . . . 0.25 110.472 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 69.4 m -64.46 -48.12 76.46 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.165 -0.47 . . . . 0.40000000000000002 110.955 177.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -56.95 -39.56 74.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.814 0.34 . . . . 3.1299999999999999 110.094 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.624 HD13 ' HB2' ' A' ' 5' ' ' ASN . 5.6 tt -60.93 -52.08 66.55 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.702 -0.851 . . . . 0.94999999999999996 108.702 173.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -50.58 -49.09 57.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.742 -0.663 . . . . 0.46000000000000002 112.023 179.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.96 -53.43 6.75 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.028 0.442 . . . . 0.58999999999999997 111.485 -174.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.7 -51.07 5.42 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 112.953 0.723 . . . . 1.45 112.953 -169.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 40.6 mt -86.68 -31.57 20.97 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.908 0.707 . . . . 1.2 112.908 -163.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 31.1 tt0 -51.76 -51.95 65.48 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 112.247 0.462 . . . . 0.75 112.247 -173.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.583 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 32.9 Cg_exo -59.48 -46.68 19.79 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 121.621 1.547 . . . . 0.56000000000000005 111.643 176.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . 0.52 ' CE2' ' HB ' ' A' ' 95' ' ' VAL . 0.5 OUTLIER -53.32 -53.32 52.7 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.658 -0.701 . . . . 1.2 110.31 177.787 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.554 HG22 ' HA2' ' A' ' 147' ' ' GLY . 45.5 mt -47.09 -52.79 4.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.446 -0.797 . . . . 0.32000000000000001 111.662 174.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.626 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.3 mm-40 -59.83 -32.01 70.27 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.129 -0.487 . . . . 0.56999999999999995 111.678 -178.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 13.4 mm-40 -64.5 -21.29 66.63 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.482 0.658 . . . . 0.78000000000000003 110.767 177.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -112.68 6.37 18.2 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.212 -0.904 . . . . 0.93000000000000005 110.786 -173.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 118.05 -46.69 1.11 Allowed Glycine 0 N--CA 1.442 -0.928 0 CA-C-N 115.501 -0.772 . . . . 0.56000000000000005 113.099 173.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . 0.554 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 132.74 -171.68 21.58 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.322 -0.942 . . . . 0.48999999999999999 112.476 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.446 ' NE1' HD13 ' A' ' 142' ' ' ILE . 19.7 m-90 -80.02 -45.92 17.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.96 0.409 . . . . 3.5699999999999998 110.427 -178.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.444 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 18.9 t70 -56.86 -37.88 71.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.412 -0.813 . . . . 1.96 110.018 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.653 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 90.6 m -59.37 -36.65 76.15 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.346 -0.843 . . . . 0.67000000000000004 111.384 178.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.605 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 62.6 t80 -63.63 -35.74 81.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.921 0.391 . . . . 3.0 110.493 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.603 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 0.7 OUTLIER -74.51 -25.3 19.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.463 0.649 . . . . 1.1499999999999999 109.67 178.197 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 7.0 mm-40 -70.1 -26.54 64.03 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.736 -0.665 . . . . 1.6699999999999999 109.383 173.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.653 ' HG ' ' O ' ' A' ' 150' ' ' THR . 12.1 mt -83.24 -58.63 2.76 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.545 -0.752 . . . . 1.3 110.338 177.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -114.51 -42.34 3.31 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.597 -0.274 . . . . 4.2400000000000002 110.495 -175.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.57 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . 47.54 -156.01 0.94 Allowed Glycine 0 CA--C 1.506 -0.474 0 O-C-N 123.89 0.744 . . . . 1.1000000000000001 114.037 -177.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.743 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 26.3 t-20 . . . . . 0 N--CA 1.43 -1.456 0 CA-C-N 114.844 -0.678 . . . . 1.29 110.113 -176.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.464 0 N-CA-C 114.63 0.612 . . . . 1.2 114.63 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . 0.418 ' HA ' ' HD3' ' B' 1006 ' ' ARG . 31.8 mmt180 -105.71 -26.92 11.6 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.371 0.878 . . . . 2.8799999999999999 113.371 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -78.68 -61.36 2.04 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.282 0.845 . . . . 1.3100000000000001 113.282 -165.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.738 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 1.3 mm? -65.31 -44.65 87.2 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.734 -0.839 . . . . 1.3300000000000001 108.734 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 0.973 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -37.25 -52.03 1.05 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.512 -1.222 . . . . 0.88 110.855 169.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -76.75 -46.63 24.51 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 113.807 -1.542 . . . . 1.03 111.918 -174.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -68.67 -24.91 64.58 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.36 -0.382 . . . . 1.6699999999999999 111.042 -178.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -72.72 -14.24 78.07 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.966 -0.561 . . . . 0.78000000000000003 112.464 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 13.3 t70 -64.78 -20.26 66.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.345 0.593 . . . . 1.8999999999999999 110.455 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 15.5 m . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 115.831 -0.622 . . . . 1.4399999999999999 111.889 -177.324 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 . . . . . 0 C--O 1.226 -0.155 0 CA-C-O 121.088 0.47 . . . . 2.4199999999999999 110.468 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 p -63.4 -23.5 67.43 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.623 -0.717 . . . . 1.25 112.028 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.909 ' HA ' HD22 ' A' ' 8' ' ' LEU . 73.1 m-20 -62.62 -28.18 69.73 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.308 0.575 . . . . 1.78 109.806 176.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.517 ' O ' HG23 ' A' ' 10' ' ' VAL . 7.0 tpp180 -60.64 -48.6 81.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.226 -0.897 . . . . 1.3999999999999999 110.22 177.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -56.76 -51.45 68.86 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.392 -0.822 . . . . 0.68000000000000005 111.209 -178.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.909 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.0 OUTLIER -47.62 -42.68 24.76 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.536 -0.756 . . . . 1.1599999999999999 110.912 177.531 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.488 HG11 ' HA ' ' A' ' 127' ' ' ALA . 73.1 t -68.88 -63.7 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.46 -0.791 . . . . 0.27000000000000002 110.195 176.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 6' ' ' ARG . 97.7 t -49.31 -53.68 8.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.416 -0.811 . . . . 0.33000000000000002 112.979 -176.277 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -57.81 -34.09 69.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.007 0.432 . . . . 0.58999999999999997 110.598 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.753 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.7 t80 -75.79 -46.52 30.25 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.111 -0.495 . . . . 1.6100000000000001 110.671 -179.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 1.058 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.5 mp -59.87 -42.72 94.33 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 120.787 -0.365 . . . . 0.34000000000000002 110.311 178.375 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.413 ' HA ' HD12 ' A' ' 17' ' ' LEU . 37.8 t -60.34 -38.89 85.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.951 -0.568 . . . . 1.05 110.47 178.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -71.33 -18.07 62.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.751 -0.659 . . . . 1.22 110.75 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.734 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 10.1 mmpt? -84.86 -46.36 11.4 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 121.368 0.604 . . . . 1.4099999999999999 110.252 -179.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.757 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 14.6 mt -55.95 -26.92 50.11 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.125 -0.943 . . . . 1.3500000000000001 111.276 177.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.6 t -58.55 -35.11 71.81 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.175 -0.921 . . . . 0.93999999999999995 112.522 176.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.734 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 27.8 pt20 -80.43 -7.94 59.34 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.989 0.737 . . . . 1.3700000000000001 112.989 -170.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 1.018 ' HZ2' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -111.93 -20.14 12.12 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 122.164 0.983 . . . . 2.2000000000000002 109.238 178.545 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.09 28.1 6.29 Favored Glycine 0 C--N 1.306 -1.134 0 CA-C-N 113.652 -1.613 . . . . 0.53000000000000003 112.741 174.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.545 ' HD1' ' HE3' ' A' ' 20' ' ' LYS . 70.8 m-85 -110.17 166.25 11.11 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.716 0.293 . . . . 0.76000000000000001 110.83 172.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.514 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 4.0 t -110.62 154.98 23.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.341 -0.391 . . . . 0.52000000000000002 110.554 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.571 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 68.0 t-105 -72.64 -54.5 8.88 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.101 -0.5 . . . . 3.3599999999999999 110.252 174.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.4 t -62.38 -27.52 69.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.699 -0.682 . . . . 1.3700000000000001 111.776 -173.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.514 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 95.3 mt-30 -59.26 -26.6 65.06 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 111.898 0.333 . . . . 1.1100000000000001 111.898 178.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -119.94 -10.73 9.42 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.086 0.402 . . . . 1.28 112.086 -173.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.548 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 49.3 m -101.89 179.53 4.3 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 113.627 0.973 . . . . 1.8100000000000001 113.627 -169.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.437 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 0.8 OUTLIER -156.08 -14.26 0.1 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.376 -1.284 . . . . 2.3100000000000001 110.015 -179.015 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.905 HG23 ' H ' ' A' ' 31' ' ' GLU . 12.3 m -51.95 -71.56 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.479 -1.237 . . . . 0.92000000000000004 112.76 -169.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.905 ' H ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -99.9 1.22 42.61 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-O 121.54 0.686 . . . . 2.7400000000000002 109.672 177.844 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.437 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.5 tt0 . . . . . 0 N--CA 1.446 -0.655 0 CA-C-N 114.697 -1.138 . . . . 1.45 111.157 -178.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.798 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.6 OUTLIER . . . . . 0 CA--C 1.541 0.6 0 CA-C-O 120.89 0.376 . . . . 1.1200000000000001 110.46 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.798 ' H ' HG23 ' A' ' 41' ' ' THR . 15.4 pt-20 -93.53 -27.82 16.42 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-O 123.176 1.465 . . . . 2.02 107.908 166.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.503 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.1 OUTLIER -66.83 -20.92 66.03 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 111.676 -2.511 . . . . 1.25 113.954 -167.577 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 35.5 tt0 -54.89 -59.84 4.18 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.933 -0.307 . . . . 1.9099999999999999 111.012 -179.201 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.465 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -64.58 -36.35 83.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.223 0.535 . . . . 0.52000000000000002 110.034 179.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.566 ' HA ' HG12 ' A' ' 152' ' ' VAL . 99.4 t -59.5 -60.74 2.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 114.917 -1.038 . . . . 1.4099999999999999 111.14 178.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.485 ' HB3' HD12 ' A' ' 8' ' ' LEU . 11.2 ptpt -62.42 -35.13 78.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.624 0.726 . . . . 0.67000000000000004 109.255 -176.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.669 ' NE2' ' HD3' ' A' ' 51' ' ' ARG . 7.1 mm100 -65.95 -32.31 73.73 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.941 -1.027 . . . . 0.98999999999999999 110.826 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.695 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -74.5 -43.88 53.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.13 0.49 . . . . 0.41999999999999998 110.624 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.474 ' O ' ' HE2' ' A' ' 12' ' ' PHE . 8.0 mp -63.25 -26.54 68.83 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.429 -0.805 . . . . 1.3300000000000001 112.88 -174.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.669 ' HD3' ' NE2' ' A' ' 48' ' ' GLN . 10.4 ptm180 -78.51 -32.41 48.09 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.156 -1.053 . . . . 2.1699999999999999 108.156 -175.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 3.7 mm-40 -80.41 -44.19 19.75 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 113.565 -1.652 . . . . 1.1000000000000001 109.907 -179.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.29 -41.08 98.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.486 -0.779 . . . . 0.53000000000000003 110.169 175.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.729 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.16 -42.23 98.49 Favored Glycine 0 C--O 1.22 -0.759 0 CA-C-N 115.558 -0.746 . . . . 0.69999999999999996 112.001 177.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.59 ' O ' HD22 ' A' ' 59' ' ' LEU . 29.8 t70 -53.46 -37.78 62.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.948 0.404 . . . . 1.04 111.296 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -71.93 -24.92 61.71 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.729 -0.669 . . . . 2.29 111.863 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -84.01 -44.62 13.96 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 112.103 0.408 . . . . 2.29 112.103 174.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.729 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.3 mt-10 -66.02 -46.27 78.48 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.111 0.782 . . . . 1.3 113.111 -164.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.59 HD22 ' O ' ' A' ' 55' ' ' ASP . 2.5 pt? -53.46 -31.22 44.62 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.014 -0.539 . . . . 1.54 111.347 -173.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 67.2 mtt-85 -64.93 -53.71 42.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.549 -0.75 . . . . 2.5800000000000001 111.741 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.719 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 15.3 p90 -90.76 -3.8 57.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.595 -0.275 . . . . 5.3200000000000003 111.119 -176.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.4 ttt180 -53.59 -34.87 59.93 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.469 0.544 . . . . 4.4800000000000004 112.469 -172.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -64.77 -33.88 77.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.992 0.425 . . . . 4.7199999999999998 110.761 177.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.582 ' HB1' HD13 ' A' ' 68' ' ' LEU . . . -78.37 -28.91 47.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.891 -0.595 . . . . 1.1699999999999999 110.577 -178.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.573 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 52.7 t80 -44.3 -46.91 9.42 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.543 0.572 . . . . 2.8100000000000001 112.543 -176.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 36.7 t -62.76 -44.68 95.55 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.894 0.378 . . . . 2.1899999999999999 110.744 -177.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.75 -29.12 40.43 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.104 -0.498 . . . . 2.7200000000000002 111.549 -176.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.727 ' HA ' ' HG3' ' A' ' 71' ' ' GLN . 4.1 mp -61.6 -24.37 66.64 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.677 0.621 . . . . 1.5600000000000001 112.677 -175.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.475 HG22 HG13 ' A' ' 74' ' ' ILE . 21.2 p -57.73 -29.13 64.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.171 0.51 . . . . 0.69999999999999996 110.719 178.479 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.5 t -76.8 -38.87 53.17 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.566 -0.743 . . . . 1.3400000000000001 109.768 176.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.727 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 6.5 mt-30 -65.63 -47.17 76.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.32 -0.854 . . . . 1.4199999999999999 110.161 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.602 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.2 mt -74.8 -31.4 61.72 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.753 -0.658 . . . . 1.3700000000000001 110.545 178.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.468 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 49.2 m80 71.86 54.64 0.19 Allowed 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.563 0.697 . . . . 2.7200000000000002 109.276 -176.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.478 HG21 ' HB3' ' A' ' 113' ' ' GLU . 15.2 mm -58.58 118.47 2.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 114.165 -1.379 . . . . 0.91000000000000003 110.666 -179.732 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.758 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -156.39 -170.41 0.24 Allowed Pre-proline 0 CA--C 1.546 0.827 0 N-CA-C 107.98 -1.118 . . . . 0.51000000000000001 107.98 -169.214 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.758 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 38.4 Cg_exo -29.47 166.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.278 0 C-N-CA 124.814 3.676 . . . . 0.46999999999999997 115.091 163.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -33.24 -24.08 0.01 OUTLIER Glycine 0 N--CA 1.471 1.0 0 N-CA-C 117.259 1.664 . . . . 0.40000000000000002 117.259 -174.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.453 ' N ' ' O ' ' A' ' 76' ' ' PRO . 17.2 p -71.96 6.3 2.17 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 117.994 0.897 . . . . 0.56000000000000005 112.216 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.57 -12.64 61.56 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.165 0.507 . . . . 0.34000000000000002 110.19 174.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.453 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 1.8 p90 -76.0 -15.13 60.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.013 -0.539 . . . . 4.1299999999999999 109.841 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.472 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 36.3 mt-30 -83.38 -26.31 30.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.451 -0.795 . . . . 1.03 109.793 173.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.544 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.2 m -74.48 -50.12 19.56 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.041 -0.981 . . . . 0.47999999999999998 109.392 172.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -65.54 -18.29 65.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.991 -1.004 . . . . 1.1799999999999999 110.06 175.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.574 ' HA ' HG12 ' A' ' 87' ' ' VAL . 37.9 tt0 -62.84 -49.02 76.54 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.258 -0.883 . . . . 0.80000000000000004 110.57 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.409 ' O ' ' HG2' ' A' ' 89' ' ' GLU . 73.5 mt-30 -48.1 -36.43 13.2 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.716 -1.129 . . . . 1.6200000000000001 110.125 177.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.79 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.0 OUTLIER -81.37 -54.58 9.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 114.452 -1.249 . . . . 1.3 111.026 -176.108 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.574 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.6 p -59.33 -23.45 25.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 122.038 0.923 . . . . 0.84999999999999998 109.396 -177.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.7 m-80 -71.31 -58.46 3.51 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 113.945 -1.48 . . . . 0.91000000000000003 110.894 172.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 1.028 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.0 OUTLIER -62.26 -38.8 90.69 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-O 121.967 0.889 . . . . 2.8700000000000001 109.358 -174.396 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' A' ' 86' ' ' VAL . 1.7 tp -56.12 -30.55 62.25 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 113.194 -1.821 . . . . 1.28 110.912 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.574 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 71.6 t80 -94.35 -33.38 13.2 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.488 -0.324 . . . . 2.2999999999999998 111.839 -168.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.91 -45.99 47.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 122.119 0.961 . . . . 5.0599999999999996 110.213 -175.286 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -95.82 20.63 9.61 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 113.803 -1.544 . . . . 3.1200000000000001 112.568 -159.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.473 ' O ' ' HG2' ' A' ' 99' ' ' ARG . . . 130.16 68.56 0.11 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 118.141 -1.981 . . . . 2.3100000000000001 115.757 174.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.66 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 61.2 t -73.04 98.71 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 118.593 1.196 . . . . 1.0600000000000001 110.23 173.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.598 ' ND2' ' HB3' ' A' ' 99' ' ' ARG . 3.3 p30 -111.98 -174.46 2.47 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.537 -1.21 . . . . 2.1200000000000001 109.24 175.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.643 ' HA ' ' CE2' ' A' ' 151' ' ' PHE . 16.1 m-90 -61.68 -45.62 93.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.979 -0.555 . . . . 3.3399999999999999 110.856 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.42 ' O ' HG13 ' A' ' 101' ' ' VAL . . . -77.43 -37.0 32.46 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.905 -0.589 . . . . 0.68999999999999995 113.456 -174.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.67 ' NH2' HD11 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -64.83 -29.14 70.09 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 122.433 -0.451 . . . . 4.2400000000000002 110.524 -177.168 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.563 HG22 ' HE1' ' A' ' 104' ' ' PHE . 45.4 mt -68.58 -36.91 76.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 C-N-CA 120.231 -0.587 . . . . 0.44 110.314 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.42 HG13 ' O ' ' A' ' 98' ' ' GLY . 0.6 OUTLIER -59.46 -31.46 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 109.562 -0.532 . . . . 1.3500000000000001 109.562 175.946 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 99' ' ' ARG . . . -65.74 -35.36 80.5 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.837 -0.62 . . . . 0.44 111.06 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.464 ' HB3' ' O ' ' A' ' 100' ' ' ILE . 17.4 t80 -60.95 -32.78 72.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.114 -0.948 . . . . 1.49 109.95 177.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.721 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 89.1 m-85 -80.27 -35.94 35.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.945 -0.57 . . . . 3.29 110.4 175.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.753 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 20.0 m -61.44 -53.58 54.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.082 -0.508 . . . . 1.1899999999999999 110.658 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.553 ' HZ ' HD11 ' A' ' 72' ' ' LEU . 32.2 t80 -73.46 -33.61 64.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.06 -0.518 . . . . 2.8900000000000001 110.392 -178.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.474 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -67.93 -44.83 77.29 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.974 -0.631 . . . . 0.29999999999999999 111.835 178.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 1.058 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.22 -31.67 81.37 Favored Glycine 0 N--CA 1.442 -0.914 0 N-CA-C 111.097 -0.801 . . . . 0.23000000000000001 111.097 175.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.573 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -68.52 -34.77 76.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.304 -0.448 . . . . 0.31 109.887 176.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.455 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.2 OUTLIER -64.2 -35.63 81.44 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.909 0.861 . . . . 1.1200000000000001 110.169 -178.52 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.721 ' SG ' HD21 ' A' ' 17' ' ' LEU . 41.4 t -52.55 -49.16 65.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.51 -1.223 . . . . 0.26000000000000001 109.478 172.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 1.018 HG13 ' HZ2' ' A' ' 20' ' ' LYS . 94.5 t -64.59 -37.15 79.32 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 CA-C-N 116.272 -0.422 . . . . 0.34999999999999998 110.557 175.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.478 ' HB3' HG21 ' A' ' 74' ' ' ILE . 46.5 mt-10 -56.44 -34.85 67.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.96 0.41 . . . . 2.5099999999999998 110.965 176.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.419 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 26.6 m -79.34 -36.75 38.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.366 0.603 . . . . 0.28000000000000003 109.715 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.679 HG23 ' O ' ' A' ' 111' ' ' CYS . 98.1 t -69.34 -32.19 52.46 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.993 0.902 . . . . 1.23 109.427 -178.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -56.83 -50.05 73.56 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.596 -1.638 . . . . 0.59999999999999998 111.302 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 35.9 mmtt -85.87 13.8 6.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.795 -0.639 . . . . 1.6200000000000001 110.608 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 62.16 48.45 4.97 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.626 0.727 . . . . 1.8799999999999999 110.497 -178.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 31.4 mtm -126.67 44.09 2.96 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.909 -1.145 . . . . 0.31 107.909 -178.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.629 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 12.4 mp0 -61.75 -6.99 2.99 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.927 -1.033 . . . . 1.1499999999999999 113.31 -171.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.511 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 34.2 m -65.55 -25.32 36.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 120.771 0.32 . . . . 0.46000000000000002 111.029 176.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.626 HD13 ' HD2' ' A' ' 125' ' ' ARG . 2.9 mm? -73.89 -25.3 59.95 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 116.563 -0.289 . . . . 0.26000000000000001 110.556 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.714 HG13 ' SG ' ' A' ' 111' ' ' CYS . 53.2 t -44.13 -53.12 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 O-C-N 123.63 0.581 . . . . 0.25 112.211 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.548 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 6.4 t -78.32 -22.2 48.48 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.097 0.475 . . . . 1.3500000000000001 110.687 -177.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.626 ' HD2' HD13 ' A' ' 122' ' ' LEU . 75.1 mtt180 -79.33 -44.87 20.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.093 -0.503 . . . . 2.6699999999999999 110.897 -177.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.679 ' HA ' ' CE3' ' A' ' 129' ' ' TRP . 85.6 mt -56.15 -47.46 80.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.838 -0.619 . . . . 0.23000000000000001 110.781 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.571 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -59.2 -35.95 74.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.818 0.342 . . . . 0.28999999999999998 111.024 178.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -58.1 -58.72 7.17 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.58 0.705 . . . . 0.28000000000000003 110.383 175.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.679 ' CE3' ' HA ' ' A' ' 126' ' ' ILE . 16.6 m0 -56.12 -48.46 76.16 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.22 -1.354 . . . . 3.9100000000000001 110.32 -178.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.541 ' SD ' HG22 ' A' ' 126' ' ' ILE . 91.3 mtp -59.06 -55.02 40.49 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.658 -0.701 . . . . 1.0800000000000001 111.787 -176.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.22 -38.66 87.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.137 -0.483 . . . . 0.25 111.42 -177.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 47.8 m -65.66 -47.21 76.28 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.73 -0.388 . . . . 0.40000000000000002 110.7 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.627 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 5.5 m-85 -56.36 -36.06 68.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.3 -0.409 . . . . 3.1299999999999999 110.529 177.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.847 HD13 ' HB3' ' A' ' 5' ' ' ASN . 4.2 tt -62.28 -58.38 7.92 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.786 -0.82 . . . . 0.94999999999999996 108.786 170.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -48.38 -45.66 36.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.338 -0.846 . . . . 0.46000000000000002 112.842 -176.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -88.96 -45.81 9.38 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.056 0.391 . . . . 0.58999999999999997 112.056 -175.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . 0.627 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 31.0 m-70 -91.25 -48.98 6.62 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.414 0.524 . . . . 1.45 112.414 -170.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.764 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -88.52 -44.24 10.82 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 113.819 1.044 . . . . 1.2 113.819 -168.603 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.62 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 34.8 tt0 -43.44 -53.15 12.09 Favored Pre-proline 0 C--N 1.323 -0.566 0 O-C-N 123.831 0.707 . . . . 0.75 112.8 -174.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.654 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 10.8 Cg_endo -54.37 -49.44 16.92 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 121.857 1.705 . . . . 0.56000000000000005 111.574 177.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 5.0 t-105 -55.99 -52.99 62.22 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.556 -0.747 . . . . 1.2 110.341 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.57 HD12 ' HA ' ' A' ' 139' ' ' GLU . 43.6 mt -46.55 -52.29 3.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.804 -0.634 . . . . 0.32000000000000001 111.812 176.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.62 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.8 mm-40 -60.25 -32.09 70.82 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.766 -0.652 . . . . 0.56999999999999995 111.782 -179.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.654 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.6 mm-40 -65.44 -21.43 66.65 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 121.659 0.742 . . . . 0.78000000000000003 110.464 177.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -107.87 9.57 28.77 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.019 -0.991 . . . . 0.93000000000000005 110.016 -174.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 121.46 -29.37 5.7 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.902 -1.045 . . . . 0.56000000000000005 113.38 171.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 108.64 166.11 20.89 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.649 -0.786 . . . . 0.48999999999999999 111.227 -175.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.786 ' HZ2' HD11 ' A' ' 134' ' ' LEU . 16.9 m95 -57.16 -40.39 77.15 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.82 0.674 . . . . 3.5699999999999998 112.82 -174.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.534 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 9.9 m-20 -55.35 -41.61 72.76 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.303 -0.258 . . . . 1.96 110.303 177.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.606 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 23.4 m -56.58 -38.55 72.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.234 -0.439 . . . . 0.67000000000000004 111.508 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.643 ' CE2' ' HA ' ' A' ' 97' ' ' TRP . 1.2 m-85 -61.29 -36.77 81.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.543 0.687 . . . . 3.0 109.44 -178.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.566 HG12 ' HA ' ' A' ' 46' ' ' VAL . 0.7 OUTLIER -80.32 -25.41 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 115.382 -0.827 . . . . 1.1499999999999999 110.042 178.115 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 6.6 mm-40 -64.56 -29.73 70.75 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.135 0.493 . . . . 1.6699999999999999 109.902 173.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 150' ' ' THR . 9.5 mt -82.96 -56.44 3.81 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.633 -0.712 . . . . 1.3 110.164 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . 0.429 ' HE2' ' HB2' ' A' ' 52' ' ' GLU . 62.5 t80 -113.48 -44.93 3.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.296 -0.411 . . . . 4.2400000000000002 110.752 -176.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.695 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . 43.36 -157.15 0.12 Allowed Glycine 0 CA--C 1.502 -0.746 0 CA-C-O 121.769 0.65 . . . . 1.1000000000000001 113.829 -177.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.65 ' ND2' HE21 ' A' ' 48' ' ' GLN . 27.4 t-20 . . . . . 0 N--CA 1.426 -1.636 0 CA-C-N 114.776 -0.712 . . . . 1.29 109.745 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . 0.936 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 N--CA 1.439 -1.165 0 N-CA-C 110.366 -1.094 . . . . 1.2 110.366 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -121.46 -32.29 3.87 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.952 0.501 . . . . 2.8799999999999999 111.878 174.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -82.26 -54.14 5.48 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.256 -0.429 . . . . 1.3100000000000001 112.114 -167.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.567 ' H ' HD22 ' B' 1008 ' ' LEU . 2.2 mm? -70.03 -31.69 69.45 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.076 -0.713 . . . . 1.3300000000000001 109.076 -177.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 1.028 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -49.89 -45.34 50.66 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.367 -1.288 . . . . 0.88 109.782 172.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -85.23 -49.41 8.22 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 113.178 -1.828 . . . . 1.03 111.498 -174.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -65.58 -23.56 66.87 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.048 -0.524 . . . . 1.6699999999999999 110.498 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.82 -11.35 83.52 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.932 -0.576 . . . . 0.78000000000000003 112.934 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 32.6 t70 -71.84 -15.43 62.13 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.5 0.667 . . . . 1.8999999999999999 109.654 170.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.45 -0.436 0 CA-C-N 115.553 -0.749 . . . . 1.4399999999999999 110.223 -178.723 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.3 mp0 . . . . . 0 CA--C 1.529 0.15 0 CA-C-O 120.917 0.389 . . . . 2.4199999999999999 111.072 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m -82.13 -17.92 44.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.167 -0.469 . . . . 1.25 111.068 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.767 ' HA ' HD22 ' A' ' 8' ' ' LEU . 76.2 m-20 -62.64 -22.1 66.18 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 121.218 0.532 . . . . 1.78 109.756 177.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.547 ' HA ' ' CB ' ' A' ' 131' ' ' ALA . 11.7 tpp85 -57.78 -43.53 85.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.276 -0.875 . . . . 1.3999999999999999 110.573 176.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -61.58 -49.16 77.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.71 -0.677 . . . . 0.68000000000000005 111.242 -177.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.767 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.3 OUTLIER -50.04 -32.99 16.83 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.129 -0.942 . . . . 1.1599999999999999 111.383 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.449 HG11 ' HA ' ' A' ' 127' ' ' ALA . 79.5 t -79.53 -62.25 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.79 -0.641 . . . . 0.27000000000000002 110.24 173.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.532 HG13 ' CE2' ' A' ' 24' ' ' TRP . 73.2 t -48.58 -54.73 4.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.504 -0.771 . . . . 0.33000000000000002 112.553 -176.159 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -57.08 -37.49 71.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.094 -0.503 . . . . 0.58999999999999997 110.524 -177.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.744 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 19.2 t80 -69.8 -46.49 65.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.939 -0.573 . . . . 1.6100000000000001 110.501 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 1.056 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.9 mp -62.01 -39.48 92.39 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 120.98 -0.288 . . . . 0.34000000000000002 110.45 178.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.3 m -58.63 -42.21 87.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.395 0.617 . . . . 1.05 110.205 176.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -67.47 -17.84 64.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.108 -0.951 . . . . 1.22 111.108 -178.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.632 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.4 mmpt? -85.96 -49.1 8.1 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.525 0.679 . . . . 1.4099999999999999 109.777 -178.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.582 HD21 ' SG ' ' A' ' 111' ' ' CYS . 12.4 mt -59.33 -28.31 66.7 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.965 -1.016 . . . . 1.3500000000000001 111.26 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.3 t -56.82 -43.88 81.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.427 -0.806 . . . . 0.93999999999999995 111.678 177.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 12.4 pt20 -80.64 2.02 27.53 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.995 0.426 . . . . 1.3700000000000001 111.587 -178.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.764 ' HE2' HG11 ' A' ' 112' ' ' VAL . 20.7 mmmt -107.39 -28.54 9.79 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.913 0.863 . . . . 2.2000000000000002 109.032 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 22.25 10.4 Favored Glycine 0 N--CA 1.441 -0.999 0 CA-C-N 113.888 -1.505 . . . . 0.53000000000000003 111.576 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -113.61 161.73 17.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.862 0.363 . . . . 0.76000000000000001 110.691 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.3 t -102.33 145.94 28.75 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.998 -0.546 . . . . 0.52000000000000002 110.259 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.532 ' CE2' HG13 ' A' ' 10' ' ' VAL . 48.2 t-105 -75.09 -51.77 12.68 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.598 -0.728 . . . . 3.3599999999999999 109.192 174.471 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.407 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 4.8 m -60.01 -34.48 73.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.378 -0.828 . . . . 1.3700000000000001 111.976 -174.239 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -61.45 -28.78 69.52 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.781 0.325 . . . . 1.1100000000000001 111.536 -179.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -120.85 19.06 11.8 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.192 -0.458 . . . . 1.28 111.253 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.545 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 53.7 p -99.81 -178.72 3.95 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.592 0.71 . . . . 1.8100000000000001 112.034 -172.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.527 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.0 OUTLIER -165.43 -25.69 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.429 -1.26 . . . . 2.3100000000000001 109.304 -179.364 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.915 HG23 ' H ' ' A' ' 31' ' ' GLU . 10.7 m -50.63 -71.89 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 114.387 -1.279 . . . . 0.92000000000000004 112.864 -173.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.915 ' H ' HG23 ' A' ' 30' ' ' VAL . 9.0 pt-20 -94.82 0.38 54.82 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.929 -0.767 . . . . 2.7400000000000002 108.929 177.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.527 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 30.5 tt0 . . . . . 0 N--CA 1.446 -0.663 0 CA-C-N 114.671 -1.15 . . . . 1.45 110.577 -178.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.645 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.5 OUTLIER . . . . . 0 CA--C 1.537 0.445 0 CA-C-O 120.366 0.127 . . . . 1.1200000000000001 110.757 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.645 ' H ' HG23 ' A' ' 41' ' ' THR . 0.0 OUTLIER -91.85 -35.36 14.12 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 121.717 0.77 . . . . 2.02 109.486 172.883 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.745 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 27.9 p -54.42 -36.96 64.55 Favored 'General case' 0 C--O 1.212 -0.886 0 CA-C-N 114.19 -1.368 . . . . 1.25 113.122 -171.044 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -42.6 -40.49 2.71 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.694 0.627 . . . . 1.9099999999999999 112.694 -171.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.582 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -87.51 -36.18 17.78 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 121.926 -0.484 . . . . 0.52000000000000002 111.543 178.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.697 HG13 ' HA ' ' A' ' 43' ' ' SER . 0.7 OUTLIER -72.63 -37.07 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.894 -0.139 . . . . 1.4099999999999999 111.18 -177.801 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.745 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.8 ptpt -67.15 -40.22 86.66 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.018 -0.734 . . . . 0.67000000000000004 109.018 175.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.62 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 5.9 mm100 -63.28 -34.62 78.07 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.317 -0.856 . . . . 0.98999999999999999 110.953 176.118 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.51 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -72.67 -38.21 67.67 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.192 0.52 . . . . 0.41999999999999998 110.841 178.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 mp -69.96 -23.88 63.25 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.624 -0.716 . . . . 1.3300000000000001 112.508 -174.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.599 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 9.3 ptp180 -84.92 -25.49 27.87 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.95 0.881 . . . . 2.1699999999999999 109.054 -175.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.62 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 10.7 mm-40 -78.05 -45.34 23.86 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.233 -1.349 . . . . 1.1000000000000001 110.202 176.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.03 -40.57 91.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.005 -0.543 . . . . 0.53000000000000003 110.129 174.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.737 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.35 -41.0 98.27 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.778 -0.646 . . . . 0.69999999999999996 112.03 178.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.469 ' O ' HD22 ' A' ' 59' ' ' LEU . 19.6 t70 -55.09 -35.31 64.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.984 0.421 . . . . 1.04 110.767 -179.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.449 ' O ' HD21 ' A' ' 59' ' ' LEU . 29.4 mm-40 -73.3 -25.96 60.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.337 -0.847 . . . . 2.29 111.898 179.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.463 ' HE1' ' HA2' ' B' 1012 ' ' GLY . 66.2 t80 -83.51 -33.31 25.56 Favored 'General case' 0 C--N 1.316 -0.858 0 O-C-N 122.205 -0.309 . . . . 2.29 111.703 177.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.737 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 39.6 mt-10 -66.34 -54.02 29.41 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.575 0.583 . . . . 1.3 112.575 -167.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.562 HD23 ' N ' ' A' ' 59' ' ' LEU . 2.1 pt? -53.75 -36.67 62.58 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.696 -0.684 . . . . 1.54 110.775 -176.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 64.9 mtt180 -52.94 -55.65 21.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.54 -0.754 . . . . 2.5800000000000001 111.717 -178.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.638 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 47.9 p90 -90.72 -4.5 56.66 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 121.134 -0.227 . . . . 5.3200000000000003 111.119 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 53.3 ttp180 -54.34 -30.4 51.37 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 122.769 0.428 . . . . 4.4800000000000004 111.646 -177.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.585 ' HD2' ' H ' ' A' ' 63' ' ' ARG . 3.3 mpt_? -66.54 -35.28 79.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.987 0.422 . . . . 4.7199999999999998 110.641 179.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.538 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.35 -27.57 17.46 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.051 -0.522 . . . . 1.1699999999999999 111.991 -179.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.58 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 51.6 t80 -41.67 -48.54 4.15 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.184 1.179 . . . . 2.8100000000000001 114.184 -169.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.3 t -63.91 -44.25 93.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.932 0.396 . . . . 2.1899999999999999 110.682 -173.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -72.63 -32.57 66.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.97 -0.559 . . . . 2.7200000000000002 111.067 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.579 HD22 ' NE2' ' A' ' 71' ' ' GLN . 14.5 mt -58.87 -23.53 61.03 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 112.929 0.714 . . . . 1.5600000000000001 112.929 -174.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.444 HG22 HG13 ' A' ' 74' ' ' ILE . 16.9 p -57.39 -26.27 60.82 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 118.33 0.514 . . . . 0.69999999999999996 111.217 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -73.35 -24.81 60.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.712 -0.676 . . . . 1.3400000000000001 109.938 177.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.579 ' NE2' HD22 ' A' ' 68' ' ' LEU . 16.3 mt-30 -87.41 -40.06 14.72 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.456 -0.793 . . . . 1.4199999999999999 110.163 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.652 HD21 ' HZ ' ' A' ' 106' ' ' PHE . 3.3 mm? -65.56 -32.55 74.21 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.746 -0.465 . . . . 1.3700000000000001 109.746 173.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 72.7 t60 66.33 44.33 2.48 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 107.673 -1.232 . . . . 2.7200000000000002 107.673 -173.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.598 HG22 ' HE1' ' A' ' 119' ' ' MET . 26.3 mm -51.35 118.33 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 113.759 -1.564 . . . . 0.91000000000000003 111.541 -179.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.773 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.32 -171.82 0.3 Allowed Pre-proline 0 C--N 1.316 -0.877 0 N-CA-C 107.301 -1.37 . . . . 0.51000000000000001 107.301 -170.838 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.773 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 39.2 Cg_exo -29.07 165.36 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 125.07 3.847 . . . . 0.46999999999999997 115.576 165.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.43 -28.53 0.01 OUTLIER Glycine 0 N--CA 1.475 1.279 0 N-CA-C 117.826 1.891 . . . . 0.40000000000000002 117.826 -172.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.45 ' N ' ' O ' ' A' ' 76' ' ' PRO . 35.1 p -69.13 6.92 0.83 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 118.21 1.005 . . . . 0.56000000000000005 112.476 -179.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.81 -11.84 60.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.244 0.545 . . . . 0.34000000000000002 110.192 174.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -76.52 -18.06 58.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.961 -0.563 . . . . 4.1299999999999999 109.673 175.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.431 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 32.8 mt-30 -84.27 -24.22 30.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.895 0.855 . . . . 1.03 109.329 173.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.5 m -71.48 -50.46 31.38 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.542 -1.208 . . . . 0.47999999999999998 109.23 170.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -67.85 -18.69 64.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.252 -0.886 . . . . 1.1799999999999999 110.167 175.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.585 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.7 tt0 -59.73 -52.17 66.63 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-O 121.605 0.717 . . . . 0.80000000000000004 110.026 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.427 ' O ' ' HG2' ' A' ' 89' ' ' GLU . 57.4 mm-40 -47.47 -35.07 8.12 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.707 -1.588 . . . . 1.6200000000000001 110.781 177.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.861 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -86.36 -49.76 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 CA-C-N 114.519 -1.219 . . . . 1.3 111.054 -175.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.585 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.7 p -62.81 -22.72 31.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.979 0.895 . . . . 0.84999999999999998 109.361 -178.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.606 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 2.6 m-80 -71.08 -52.21 20.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.306 -1.315 . . . . 0.91000000000000003 111.146 174.225 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 1.028 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.0 OUTLIER -67.51 -38.22 83.98 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-O 121.754 0.787 . . . . 2.8700000000000001 109.346 -177.039 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.463 ' HG ' ' OE2' ' A' ' 89' ' ' GLU . 18.2 mt -63.01 -24.87 68.12 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 113.867 -1.515 . . . . 1.28 111.46 -178.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.651 ' HA ' HG22 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -110.27 -40.61 4.63 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 112.588 0.588 . . . . 2.2999999999999998 112.588 -170.558 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.606 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER -67.8 -29.83 69.11 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.316 0.579 . . . . 5.0599999999999996 110.784 -171.318 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.528 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 1.2 m-20 -98.88 17.22 20.05 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.353 -0.84 . . . . 3.1200000000000001 112.972 -172.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.594 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 126.38 71.75 0.19 Allowed Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 117.18 -2.438 . . . . 2.3100000000000001 115.758 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.651 HG22 ' HA ' ' A' ' 91' ' ' PHE . 57.8 t -71.42 102.73 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-N 118.977 1.388 . . . . 1.0600000000000001 110.698 177.022 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -112.16 -172.53 2.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.848 -1.069 . . . . 2.1200000000000001 110.143 -178.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.703 ' HD1' ' HB3' ' A' ' 145' ' ' ASN . 74.0 t90 -51.46 -49.43 61.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.408 -0.814 . . . . 3.3399999999999999 111.799 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -86.36 -14.42 66.22 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 120.775 -0.726 . . . . 0.68999999999999995 114.04 -174.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 94' ' ' GLY . 24.9 mmt180 -64.17 -45.01 90.27 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 117.459 0.63 . . . . 4.2400000000000002 111.398 -176.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.643 ' HA ' ' CD1' ' A' ' 103' ' ' PHE . 66.7 mt -60.0 -30.83 46.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.51 -0.768 . . . . 0.44 111.542 -174.397 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 36.3 t -56.58 -54.63 26.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.653 -0.703 . . . . 1.3500000000000001 110.384 171.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.78 -40.99 63.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.304 -0.862 . . . . 0.44 111.875 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.643 ' CD1' ' HA ' ' A' ' 100' ' ' ILE . 68.1 m-85 -50.42 -56.69 10.33 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.311 0.577 . . . . 1.49 110.56 177.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.634 ' HD1' ' HE3' ' A' ' 130' ' ' MET . 17.7 m-85 -75.57 -27.4 58.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.546 -0.752 . . . . 3.29 111.178 -174.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.744 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 47.2 m -62.81 -46.36 88.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.863 0.364 . . . . 1.1899999999999999 110.452 178.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.652 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 56.5 t80 -80.84 -32.36 35.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.232 -0.44 . . . . 2.8900000000000001 110.483 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.781 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.93 -40.42 95.37 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.64 -0.791 . . . . 0.29999999999999999 111.9 176.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 1.056 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.51 -31.0 75.59 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 111.152 -0.779 . . . . 0.23000000000000001 111.152 174.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.58 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -72.42 -32.66 66.52 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 110.02 -0.363 . . . . 0.31 110.02 176.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.433 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.2 OUTLIER -65.66 -36.23 83.06 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.833 0.825 . . . . 1.1200000000000001 110.123 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.738 ' HB2' HD23 ' A' ' 13' ' ' LEU . 35.8 t -50.55 -48.01 57.51 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 114.468 -1.242 . . . . 0.26000000000000001 109.233 172.06 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.764 HG11 ' HE2' ' A' ' 20' ' ' LYS . 92.3 t -71.04 -32.64 48.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.599 -0.728 . . . . 0.34999999999999998 110.879 177.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.433 ' OE2' ' HA ' ' A' ' 110' ' ' LEU . 40.0 mt-10 -57.27 -34.46 68.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.26 0.552 . . . . 2.5099999999999998 110.223 174.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.459 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 16.6 m -77.21 -35.06 55.97 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 115.682 -0.69 . . . . 0.28000000000000003 109.312 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 111' ' ' CYS . 86.9 t -69.04 -35.21 67.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 121.91 0.862 . . . . 1.23 109.344 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -53.49 -49.28 67.84 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 113.547 -1.66 . . . . 0.59999999999999998 111.374 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -88.15 13.09 12.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.856 -0.611 . . . . 1.6200000000000001 110.387 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 61.09 52.34 4.06 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.723 0.773 . . . . 1.8799999999999999 110.335 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.598 ' HE1' HG22 ' A' ' 74' ' ' ILE . 28.7 mtm -130.96 44.37 2.97 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 107.781 -1.192 . . . . 0.31 107.781 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.659 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 15.1 mp0 -60.02 -6.66 1.43 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.746 -1.116 . . . . 1.1499999999999999 113.465 -172.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.559 HG23 HD22 ' A' ' 122' ' ' LEU . 31.4 m -65.96 -26.63 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 121.943 -0.473 . . . . 0.46000000000000002 111.553 175.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.722 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.1 mm? -71.85 -27.13 62.68 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 110.373 -0.232 . . . . 0.26000000000000001 110.373 -179.11 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.707 HG13 ' SG ' ' A' ' 111' ' ' CYS . 41.0 t -39.07 -55.56 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 O-C-N 124.33 1.019 . . . . 0.25 112.736 177.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.545 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 5.7 t -77.9 -30.54 50.71 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.642 -0.423 . . . . 1.3500000000000001 110.773 -177.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.722 ' HD2' HD13 ' A' ' 122' ' ' LEU . 88.0 mtt180 -66.57 -48.78 68.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.204 -0.453 . . . . 2.6699999999999999 110.997 -176.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.451 HD12 ' HA ' ' A' ' 111' ' ' CYS . 75.3 mt -53.66 -49.9 53.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.731 -0.668 . . . . 0.23000000000000001 110.874 178.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.556 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.53 -36.99 69.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.996 -0.547 . . . . 0.28999999999999998 112.046 -178.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.13 -57.85 10.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.459 0.647 . . . . 0.28000000000000003 110.91 178.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -65.5 -37.32 86.45 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.695 -1.139 . . . . 3.9100000000000001 111.02 -176.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.781 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 0.4 OUTLIER -61.9 -48.63 79.58 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.034 0.445 . . . . 1.0800000000000001 111.091 179.712 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.547 ' CB ' ' HA ' ' A' ' 6' ' ' ARG . . . -67.75 -37.81 82.63 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 0.25 111.227 -178.059 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 96.9 m -65.57 -45.62 82.59 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.794 -0.363 . . . . 0.40000000000000002 110.982 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.42 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 49.1 t80 -56.47 -43.36 79.53 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.554 -0.536 . . . . 3.1299999999999999 109.554 177.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.985 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.4 OUTLIER -54.9 -61.33 2.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.764 -0.653 . . . . 0.94999999999999996 109.786 170.992 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . 0.404 ' HA ' HD22 ' A' ' 5' ' ' ASN . 4.8 m-80 -43.9 -56.17 4.08 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.3 -0.864 . . . . 0.46000000000000002 112.808 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -76.94 -51.37 11.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.117 0.484 . . . . 0.58999999999999997 111.925 -174.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . 0.42 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 0.4 OUTLIER -92.0 -51.56 5.14 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.982 0.734 . . . . 1.45 112.982 -170.261 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.985 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -79.51 -42.18 25.77 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 114.492 1.293 . . . . 1.2 114.492 -165.718 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.532 ' HB3' ' HD3' ' A' ' 140' ' ' PRO . 29.2 tt0 -44.09 -48.99 23.21 Favored Pre-proline 0 N--CA 1.472 0.643 0 N-CA-C 112.906 0.706 . . . . 0.75 112.906 -174.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.585 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.0 Cg_exo -52.91 -46.77 31.46 Favored 'Trans proline' 0 C--N 1.356 0.957 0 C-N-CA 121.949 1.766 . . . . 0.56000000000000005 111.952 175.321 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -48.84 78.71 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.801 -0.636 . . . . 1.2 110.921 178.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.553 HD12 ' O ' ' A' ' 138' ' ' LEU . 1.7 mp -49.73 -47.75 21.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.142 0.496 . . . . 0.32000000000000001 110.694 177.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.509 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 70.8 mm-40 -64.44 -29.59 70.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.538 -0.756 . . . . 0.56999999999999995 111.991 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 19.1 mm-40 -62.15 -24.13 66.99 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.784 0.802 . . . . 0.78000000000000003 110.006 176.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.703 ' HB3' ' HD1' ' A' ' 97' ' ' TRP . 23.0 m-80 -104.89 10.98 34.15 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.5 -1.227 . . . . 0.93000000000000005 109.715 -174.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 106.56 -12.54 42.89 Favored Glycine 0 N--CA 1.439 -1.164 0 CA-C-N 114.618 -1.174 . . . . 0.56000000000000005 113.116 174.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . 0.517 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 102.29 174.45 27.44 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.366 -0.921 . . . . 0.48999999999999999 112.098 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.411 ' HB3' ' CB ' ' A' ' 46' ' ' VAL . 56.0 m95 -63.97 -42.95 97.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.712 0.291 . . . . 3.5699999999999998 110.936 -178.239 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.487 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 26.9 t70 -53.8 -48.99 69.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.609 . . . . 1.96 110.882 177.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.556 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 67.9 m -58.9 -34.6 71.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.724 -0.671 . . . . 0.67000000000000004 111.501 179.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -60.45 -45.27 94.29 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.698 -0.482 . . . . 3.0 109.698 -179.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.582 HG21 ' HB1' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -72.62 -26.78 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.186 -0.461 . . . . 1.1499999999999999 110.314 178.0 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 18.5 mm-40 -60.98 -29.98 70.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.952 0.406 . . . . 1.6699999999999999 110.244 173.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.9 mt -94.1 -60.25 1.78 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.146 -0.479 . . . . 1.3 110.959 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . 0.687 ' HB2' ' HH2' ' A' ' 97' ' ' TRP . 3.2 t80 -121.05 26.37 9.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.338 0.59 . . . . 4.2400000000000002 110.468 -172.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.51 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -61.45 162.59 24.39 Favored Glycine 0 CA--C 1.499 -0.966 0 CA-C-N 115.716 -0.675 . . . . 1.1000000000000001 112.83 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.579 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 26.4 t-20 . . . . . 0 C--N 1.309 -1.193 0 CA-C-N 114.12 -1.04 . . . . 1.29 110.754 178.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . 0.904 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.541 1.679 0 N-CA-C 114.188 0.435 . . . . 1.2 114.188 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . 0.401 ' O ' ' HB3' ' B' 1009 ' ' ALA . 24.2 mmt180 -139.51 -41.58 0.45 Allowed 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 123.446 0.698 . . . . 2.8799999999999999 109.754 177.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . 0.526 ' O ' ' HD1' ' B' 1011 ' ' PHE . . . -59.9 -61.06 2.89 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 116.19 -0.459 . . . . 1.3100000000000001 111.307 -177.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.838 ' H ' HD22 ' B' 1008 ' ' LEU . 1.0 OUTLIER -63.45 -39.8 95.43 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.49 -0.93 . . . . 1.3300000000000001 108.49 -179.19 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 1.028 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -48.6 -49.97 34.6 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.521 -1.218 . . . . 0.88 110.58 172.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -78.18 -43.52 28.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.704 -1.135 . . . . 1.03 112.021 -175.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . 0.526 ' HD1' ' O ' ' B' 1007 ' ' ALA . 46.3 m-85 -67.14 -26.73 66.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.223 0.535 . . . . 1.6699999999999999 110.42 178.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . 0.463 ' HA2' ' HE1' ' A' ' 57' ' ' PHE . . . -79.93 -6.77 88.98 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.45 -0.796 . . . . 0.78000000000000003 112.606 178.24 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 26.9 t70 -81.59 -2.95 51.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.483 0.658 . . . . 1.8999999999999999 109.941 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 20.2 m . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 115.883 -0.599 . . . . 1.4399999999999999 111.045 -178.88 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.639 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 76.4 mm-40 . . . . . 0 N--CA 1.462 0.139 0 N-CA-C 113.418 0.895 . . . . 2.4199999999999999 113.418 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.0 p -68.68 -18.31 64.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.109 0.48 . . . . 1.25 110.626 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.762 ' HB2' HD13 ' A' ' 134' ' ' LEU . 13.2 p30 -68.88 -20.76 64.27 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.029 -0.532 . . . . 1.78 111.06 176.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.639 ' HB2' ' O ' ' A' ' 3' ' ' GLN . 0.1 OUTLIER -51.96 -51.77 54.88 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.801 -0.636 . . . . 1.3999999999999999 110.31 175.95 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.555 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 40.2 mt-10 -59.39 -48.2 82.56 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.867 -1.06 . . . . 0.68000000000000005 111.453 -176.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.668 HD22 ' HA ' ' A' ' 5' ' ' ASN . 1.4 mp -49.61 -34.55 18.28 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.439 -0.8 . . . . 1.1599999999999999 111.087 176.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.564 HG21 ' N ' ' A' ' 131' ' ' ALA . 72.6 t -79.39 -63.1 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.498 0.666 . . . . 0.27000000000000002 109.909 174.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 6' ' ' ARG . 93.6 t -50.66 -56.6 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.471 -1.241 . . . . 0.33000000000000002 112.766 -174.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.08 -33.08 68.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.709 0.29 . . . . 0.58999999999999997 110.469 -177.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 4.0 t80 -74.97 -46.2 37.03 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.287 -0.415 . . . . 1.6100000000000001 110.735 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.95 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.9 mp -62.72 -40.79 98.3 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 120.103 -0.639 . . . . 0.34000000000000002 110.202 178.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.8 t -61.17 -40.7 94.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.172 0.51 . . . . 1.05 110.065 176.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.431 ' HD2' ' HE3' ' A' ' 16' ' ' LYS . 81.3 t80 -63.15 -22.1 66.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.529 -0.759 . . . . 1.22 110.889 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.724 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.5 mmpt? -86.35 -43.75 12.62 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.516 0.674 . . . . 1.4099999999999999 110.203 -179.057 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.658 HD21 ' SG ' ' A' ' 111' ' ' CYS . 14.5 mt -66.69 -30.86 71.2 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 115.018 -0.992 . . . . 1.3500000000000001 110.69 178.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.0 t -56.31 -43.51 79.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.541 -0.754 . . . . 0.93999999999999995 111.564 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.406 ' HG3' ' O ' ' A' ' 16' ' ' LYS . 6.8 pt20 -80.22 0.97 30.22 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.073 0.463 . . . . 1.3700000000000001 112.103 -177.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.657 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 19.9 mmmt -108.28 -26.5 10.51 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 122.113 0.959 . . . . 2.2000000000000002 108.788 177.42 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 22.28 10.37 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 113.642 -1.617 . . . . 0.53000000000000003 111.47 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.713 ' HB3' ' HE2' ' A' ' 27' ' ' PHE . 89.9 m-85 -113.13 156.39 23.27 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.855 0.36 . . . . 0.76000000000000001 110.879 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.7 t -93.13 147.75 22.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.811 -0.631 . . . . 0.52000000000000002 110.688 -179.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -73.33 -53.01 11.84 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.794 -0.639 . . . . 3.3599999999999999 110.022 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -68.4 -28.89 67.49 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.186 0.439 . . . . 1.3700000000000001 112.186 -173.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -61.22 -29.63 69.94 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.672 -0.411 . . . . 1.1100000000000001 111.363 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.713 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 13.5 m-85 -109.96 -15.34 14.09 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.3 -0.409 . . . . 1.28 111.338 -175.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.677 ' HB3' HG22 ' A' ' 30' ' ' VAL . 34.6 m -101.36 148.34 25.27 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 122.254 1.026 . . . . 1.8100000000000001 112.632 -176.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.29 -2.84 11.07 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 113.113 -1.858 . . . . 2.3100000000000001 109.149 -177.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.911 HG23 ' H ' ' A' ' 31' ' ' GLU . 5.2 m -64.66 -75.76 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 114.636 -1.166 . . . . 0.92000000000000004 113.141 -169.132 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.911 ' H ' HG23 ' A' ' 30' ' ' VAL . 10.2 mm-40 -85.24 -2.28 57.87 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 122.075 0.94 . . . . 2.7400000000000002 108.861 -179.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 . . . . . 0 N--CA 1.441 -0.916 0 CA-C-N 114.188 -1.369 . . . . 1.45 110.425 174.91 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.812 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.2 t . . . . . 0 CA--C 1.539 0.52 0 CA-C-O 120.693 0.282 . . . . 1.1200000000000001 110.408 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.812 ' H ' HG23 ' A' ' 41' ' ' THR . 17.0 pt-20 -94.7 -23.51 17.54 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 122.999 1.38 . . . . 2.02 108.291 165.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.843 ' HB2' ' HE3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -63.04 -30.0 71.25 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 111.955 -2.384 . . . . 1.25 114.562 -169.725 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -46.19 -50.31 15.88 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 118.202 0.455 . . . . 1.9099999999999999 111.614 -173.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.604 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -74.93 -37.75 61.96 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.982 0.42 . . . . 0.52000000000000002 110.368 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.626 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 72.2 t -54.93 -65.21 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.37 -0.832 . . . . 1.4099999999999999 111.306 177.132 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.843 ' HE3' ' HB2' ' A' ' 43' ' ' SER . 19.3 ptpt -60.85 -34.51 74.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.865 -0.607 . . . . 0.67000000000000004 110.176 -176.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.654 HE21 ' ND2' ' A' ' 157' ' ' ASN . 6.8 mm100 -62.34 -36.36 81.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.64 -0.709 . . . . 0.98999999999999999 111.446 174.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.774 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -76.85 -35.25 57.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.497 0.665 . . . . 0.41999999999999998 110.066 175.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.577 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -54.85 -39.29 68.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.742 -1.117 . . . . 1.3300000000000001 112.118 -179.771 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.511 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 13.0 ptp180 -79.59 -33.53 41.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.588 0.709 . . . . 2.1699999999999999 109.426 -174.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.677 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.0 mm-40 -67.95 -43.67 78.52 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.582 -1.19 . . . . 1.1000000000000001 110.218 178.082 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.57 -41.49 72.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.495 -0.775 . . . . 0.53000000000000003 110.723 177.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.697 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.41 -44.62 97.36 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.825 -0.625 . . . . 0.69999999999999996 112.52 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.57 ' O ' HD22 ' A' ' 59' ' ' LEU . 28.8 t70 -54.33 -32.01 55.64 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.074 0.464 . . . . 1.04 111.294 -178.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -80.22 -25.6 39.54 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.379 -0.828 . . . . 2.29 112.488 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.633 ' CZ ' HD12 ' B' 1008 ' ' LEU . 91.7 t80 -82.54 -43.05 17.59 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.566 0.58 . . . . 2.29 112.566 -179.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.697 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 30.4 mt-10 -58.33 -48.03 81.85 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.494 0.924 . . . . 1.3 113.494 -168.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.62 ' H ' ' CD2' ' A' ' 59' ' ' LEU . 1.0 OUTLIER -78.74 -7.81 58.13 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 123.717 0.807 . . . . 1.54 112.409 -172.119 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 67.8 mtt-85 -45.01 -27.39 0.54 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 116.221 1.934 . . . . 2.5800000000000001 116.221 -161.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -90.38 -85.94 0.21 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 117.16 -1.816 . . . . 5.3200000000000003 109.894 174.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 56.6 mtm180 -109.18 -82.06 0.57 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 119.534 1.061 . . . . 4.4800000000000004 111.636 158.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.673 ' HB2' ' OD1' ' A' ' 67' ' ' ASP . 0.0 OUTLIER -103.07 11.65 36.93 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 113.844 -1.525 . . . . 4.7199999999999998 110.966 171.182 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.739 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -27.89 -54.99 0.1 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.378 1.622 . . . . 1.1699999999999999 115.378 -150.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.453 ' CG ' ' HB3' ' A' ' 58' ' ' GLU . 19.6 p90 -47.82 -28.57 2.64 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 113.088 0.773 . . . . 2.8100000000000001 113.088 -176.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.7 m -90.69 -36.66 14.22 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.202 0.445 . . . . 2.1899999999999999 112.202 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.673 ' OD1' ' HB2' ' A' ' 63' ' ' ARG . 4.5 m-20 -83.01 -23.21 33.37 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.799 0.296 . . . . 2.7200000000000002 111.799 -174.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.739 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 32.2 mt -61.47 -15.55 38.61 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.717 1.006 . . . . 1.5600000000000001 113.717 -171.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.72 HG22 HG13 ' A' ' 74' ' ' ILE . 34.4 p -47.81 -29.27 3.06 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 123.314 0.384 . . . . 0.69999999999999996 111.482 -177.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.8 t -53.28 -59.38 4.64 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.752 -0.658 . . . . 1.3400000000000001 111.143 175.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.645 ' NE2' ' HA ' ' A' ' 68' ' ' LEU . 2.6 mp0 -54.51 -48.09 72.31 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.682 0.793 . . . . 1.4199999999999999 111.814 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.75 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.1 mp -81.25 -28.27 34.84 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.104 -0.953 . . . . 1.3700000000000001 111.922 -168.081 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.5 t-80 62.8 64.38 0.89 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 122.155 0.978 . . . . 2.7200000000000002 108.711 -177.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.72 HG13 HG22 ' A' ' 69' ' ' THR . 15.5 mm -65.03 118.54 7.54 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 113.963 -1.472 . . . . 0.91000000000000003 111.627 -174.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.729 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.26 -172.18 0.3 Allowed Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 107.47 -1.307 . . . . 0.51000000000000001 107.47 -171.247 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.729 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.3 Cg_exo -30.33 167.27 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 125.035 3.823 . . . . 0.46999999999999997 115.112 164.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.41 -25.68 0.0 OUTLIER Glycine 0 N--CA 1.475 1.239 0 N-CA-C 117.606 1.803 . . . . 0.40000000000000002 117.606 -174.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.473 ' N ' ' O ' ' A' ' 76' ' ' PRO . 34.6 p -72.05 6.76 1.95 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 118.119 0.959 . . . . 0.56000000000000005 111.514 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.46 -16.71 61.81 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 109.304 -0.628 . . . . 0.34000000000000002 109.304 169.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.543 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 66.2 t80 -76.06 -15.12 60.17 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.574 -0.739 . . . . 4.1299999999999999 109.186 174.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.501 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 78.1 mt-30 -82.85 -28.79 29.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.766 0.793 . . . . 1.03 109.487 172.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.75 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.5 m -72.05 -53.14 13.8 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.58 -1.191 . . . . 0.47999999999999998 109.687 173.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.511 ' HE1' ' HB3' ' A' ' 106' ' ' PHE . 78.8 t80 -65.13 -18.94 65.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.559 -0.746 . . . . 1.1799999999999999 110.345 175.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.64 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.6 tt0 -60.59 -46.91 88.48 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 115.724 -0.671 . . . . 0.80000000000000004 110.426 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -49.1 -34.6 14.25 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.749 -1.114 . . . . 1.6200000000000001 110.796 177.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.808 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.4 t -82.68 -54.72 8.84 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.025 -0.988 . . . . 1.3 110.867 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.64 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.8 p -60.46 -25.31 33.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.537 0.684 . . . . 0.84999999999999998 109.648 -177.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.0 OUTLIER -62.08 -56.5 18.27 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.789 -1.096 . . . . 0.91000000000000003 110.742 171.607 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.917 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.0 OUTLIER -62.05 -36.36 81.4 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 108.428 -0.953 . . . . 2.8700000000000001 108.428 -175.738 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.782 HD23 ' HE ' ' A' ' 99' ' ' ARG . 27.3 mt -70.9 -24.28 62.44 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 113.672 -1.603 . . . . 1.28 112.345 -170.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.742 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 1.7 p90 -106.81 -23.56 12.35 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.052 0.453 . . . . 2.2999999999999998 111.516 -176.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.531 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 5.8 ptm180 -88.18 -41.56 12.9 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.889 0.376 . . . . 5.0599999999999996 111.71 -172.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -100.83 18.11 20.34 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.824 0.676 . . . . 3.1200000000000001 112.824 -165.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.528 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 129.03 69.38 0.12 Allowed Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 117.574 -2.25 . . . . 2.3100000000000001 114.846 178.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.742 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 61.1 t -70.7 103.94 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 118.421 1.111 . . . . 1.0600000000000001 110.416 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.656 ' N ' HD22 ' A' ' 96' ' ' ASN . 0.7 OUTLIER -110.93 -175.06 2.62 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.973 -1.012 . . . . 2.1200000000000001 108.427 176.562 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.535 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 21.8 m-90 -54.72 -47.33 73.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.008 0.432 . . . . 3.3399999999999999 110.27 178.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.13 -30.47 71.9 Favored Glycine 0 CA--C 1.519 0.317 0 CA-C-N 115.738 -0.664 . . . . 0.68999999999999995 113.772 -176.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.782 ' HE ' HD23 ' A' ' 90' ' ' LEU . 9.9 mmm-85 -62.68 -35.61 80.23 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.4 0.619 . . . . 4.2400000000000002 110.798 -178.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.508 ' O ' ' HB3' ' A' ' 103' ' ' PHE . 72.5 mt -75.01 -41.25 45.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 CA-C-N 115.53 -0.759 . . . . 0.44 110.812 -177.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -59.53 -35.93 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 109.671 -0.492 . . . . 1.3500000000000001 109.671 174.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.16 87.27 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.786 -0.643 . . . . 0.44 110.632 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.535 ' HZ ' ' HA ' ' A' ' 130' ' ' MET . 67.4 t80 -51.9 -42.87 63.06 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.13 -0.941 . . . . 1.49 110.12 173.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.841 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 89.0 m-85 -75.41 -39.7 58.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.076 -0.511 . . . . 3.29 111.367 178.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.49 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 19.3 m -56.16 -50.13 72.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.063 0.459 . . . . 1.1899999999999999 110.365 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.511 ' HB3' ' HE1' ' A' ' 83' ' ' PHE . 1.2 t80 -79.07 -35.42 42.47 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.95 -0.568 . . . . 2.8900000000000001 110.569 -178.226 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.673 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.06 -43.46 95.7 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.75 -0.738 . . . . 0.29999999999999999 111.999 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.95 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.64 -33.02 79.7 Favored Glycine 0 N--CA 1.443 -0.89 0 N-CA-C 110.875 -0.89 . . . . 0.23000000000000001 110.875 175.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.77 -34.25 73.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.47 -0.365 . . . . 0.31 110.606 176.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.538 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.47 -39.57 94.81 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 108.257 -1.016 . . . . 1.1200000000000001 108.257 -178.806 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.679 ' SG ' HG22 ' A' ' 123' ' ' VAL . 43.9 t -52.78 -52.6 56.04 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 113.899 -1.5 . . . . 0.26000000000000001 109.913 173.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.568 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 92.6 t -68.07 -38.43 79.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.97 -0.559 . . . . 0.34999999999999998 111.686 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.5 ' HB3' HG21 ' A' ' 74' ' ' ILE . 35.7 mt-10 -58.11 -28.17 64.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.158 0.504 . . . . 2.5099999999999998 110.027 176.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.46 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 50.8 m -79.01 -41.28 29.29 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.859 -0.61 . . . . 0.28000000000000003 109.503 176.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 111' ' ' CYS . 88.0 t -64.04 -33.92 65.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 122.066 0.936 . . . . 1.23 109.455 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . 0.454 ' OD1' ' HD3' ' A' ' 117' ' ' LYS . 15.2 t70 -51.54 -50.39 60.14 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 113.401 -1.727 . . . . 0.59999999999999998 111.278 178.186 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.454 ' HD3' ' OD1' ' A' ' 116' ' ' ASP . 12.1 mmtp -88.33 13.3 11.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.061 -0.518 . . . . 1.6200000000000001 110.231 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.446 ' HA ' HE21 ' A' ' 120' ' ' GLN . 44.4 mt-10 63.2 42.84 6.76 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-O 121.657 0.742 . . . . 1.8799999999999999 110.749 -177.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.46 ' CE ' ' HA ' ' A' ' 114' ' ' SER . 29.7 mtm -116.16 46.29 1.6 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.069 -1.086 . . . . 0.31 108.069 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.446 HE21 ' HA ' ' A' ' 118' ' ' GLU . 3.7 mt-30 -61.61 -7.45 3.35 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.468 -1.242 . . . . 1.1499999999999999 112.847 -175.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.562 HG23 HD22 ' A' ' 122' ' ' LEU . 27.8 m -65.82 -27.31 40.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 122.244 -0.285 . . . . 0.46000000000000002 111.067 173.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.693 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -70.8 -29.45 65.64 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 116.569 -0.287 . . . . 0.26000000000000001 110.321 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.679 HG22 ' SG ' ' A' ' 111' ' ' CYS . 76.3 t -43.05 -55.5 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 O-C-N 124.001 0.813 . . . . 0.25 111.909 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.579 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 2.9 t -70.32 -35.0 73.36 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.779 0.323 . . . . 1.3500000000000001 110.914 -178.103 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.693 ' HD2' HD13 ' A' ' 122' ' ' LEU . 94.7 mtt180 -63.47 -56.02 19.46 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 121.13 0.491 . . . . 2.6699999999999999 110.158 -178.243 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.538 HD13 ' HB3' ' A' ' 110' ' ' LEU . 68.8 mt -51.82 -53.72 16.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.139 -0.937 . . . . 0.23000000000000001 110.964 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.532 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -54.84 -34.45 62.87 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 111.711 0.263 . . . . 0.28999999999999998 111.711 -178.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.13 -58.05 8.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.48 0.657 . . . . 0.28000000000000003 110.892 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -68.76 -26.1 65.05 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.026 -0.988 . . . . 3.9100000000000001 111.224 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.673 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 21.5 mmm -62.87 -60.57 3.29 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.168 -0.469 . . . . 1.0800000000000001 110.683 176.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.564 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -62.37 -35.11 78.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.173 -0.467 . . . . 0.25 110.972 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 89.6 m -63.71 -47.47 80.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.336 -0.393 . . . . 0.40000000000000002 111.261 176.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.408 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 3.4 t80 -60.35 -37.35 80.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.96 -0.385 . . . . 3.1299999999999999 109.96 179.708 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.841 HD12 ' HZ ' ' A' ' 104' ' ' PHE . 5.9 tt -64.1 -50.2 69.21 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.752 -0.832 . . . . 0.94999999999999996 108.752 173.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -47.95 -57.37 5.82 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.878 -0.601 . . . . 0.46000000000000002 112.028 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -80.85 -48.85 11.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.398 0.518 . . . . 0.58999999999999997 112.398 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . 0.408 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 0.3 OUTLIER -90.77 -47.81 7.41 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.127 0.788 . . . . 1.45 113.127 -169.007 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 58.2 mt -91.04 -32.89 15.73 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.011 0.745 . . . . 1.2 113.011 -165.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.629 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 29.6 tt0 -49.67 -50.23 68.07 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 111.915 0.339 . . . . 0.75 111.915 -174.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.613 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 13.3 Cg_endo -57.83 -49.7 12.36 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.902 1.735 . . . . 0.56000000000000005 111.913 175.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . 0.42 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -56.02 -47.41 77.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.721 -0.672 . . . . 1.2 110.471 179.282 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.545 HD12 ' HA ' ' A' ' 139' ' ' GLU . 15.0 mt -50.15 -50.86 19.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.609 -0.723 . . . . 0.32000000000000001 111.27 175.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.629 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 80.8 mm-40 -58.84 -34.09 71.18 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.572 -0.74 . . . . 0.56999999999999995 111.252 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.613 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 6.1 mm-40 -66.57 -21.71 66.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.381 0.61 . . . . 0.78000000000000003 110.773 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.634 ' N ' HD22 ' A' ' 145' ' ' ASN . 0.7 OUTLIER -102.42 -4.95 24.68 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.504 -0.771 . . . . 0.93000000000000005 109.787 -174.743 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 123.13 -31.92 4.54 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.479 -0.782 . . . . 0.56000000000000005 112.851 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . 0.501 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 123.45 -175.48 16.71 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.731 -0.747 . . . . 0.48999999999999999 112.046 -178.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.475 ' NE1' HD13 ' A' ' 142' ' ' ILE . 11.2 m-90 -78.68 -39.69 36.01 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.839 0.352 . . . . 3.5699999999999998 110.38 -178.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -61.98 -42.21 98.88 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.109 -0.496 . . . . 1.96 110.07 179.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.607 ' O ' HD13 ' A' ' 154' ' ' LEU . 85.0 m -57.4 -35.5 70.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.768 -0.651 . . . . 0.67000000000000004 110.869 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.535 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 78.7 t80 -60.66 -39.84 89.85 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 120.43 -0.508 . . . . 3.0 110.102 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.604 HG21 ' HB1' ' A' ' 45' ' ' ALA . 1.3 m -78.18 -26.19 14.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.158 0.504 . . . . 1.1499999999999999 110.331 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -59.33 -42.32 91.19 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.399 0.619 . . . . 1.6699999999999999 109.695 171.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.607 HD13 ' O ' ' A' ' 150' ' ' THR . 8.1 mp -80.37 -60.04 2.47 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.093 -0.958 . . . . 1.3 112.873 177.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -119.86 27.04 8.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.272 0.558 . . . . 4.2400000000000002 110.203 -168.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.774 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -57.17 161.69 8.22 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-O 122.022 0.79 . . . . 1.1000000000000001 114.665 -178.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.677 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 28.1 t-20 . . . . . 0 C--N 1.316 -0.865 0 CA-C-N 113.202 -1.499 . . . . 1.29 111.601 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.013 0 CA-C-O 120.926 0.181 . . . . 1.2 113.014 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . 0.427 HH11 ' HD2' ' B' 1006 ' ' ARG . 3.7 mpt_? -90.59 -41.74 11.18 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.776 0.322 . . . . 2.8799999999999999 111.241 175.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -70.32 -66.13 0.64 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.466 0.543 . . . . 1.3100000000000001 112.466 -171.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.633 HD12 ' CZ ' ' A' ' 57' ' ' PHE . 3.3 mm? -57.5 -40.04 77.83 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.312 0.577 . . . . 1.3300000000000001 110.18 -173.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 0.917 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -53.92 -40.19 66.48 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.642 -1.163 . . . . 0.88 110.726 176.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -80.25 -41.22 25.48 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.827 -1.078 . . . . 1.03 111.143 -177.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -70.52 -33.63 71.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.702 -0.681 . . . . 1.6699999999999999 111.581 -178.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -70.84 -24.42 77.05 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.188 -0.53 . . . . 0.78000000000000003 113.367 -175.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 38.5 t70 -74.19 -4.24 34.72 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.206 0.527 . . . . 1.8999999999999999 111.061 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 22.4 m . . . . . 0 C--N 1.328 -0.341 0 CA-C-O 121.011 0.434 . . . . 1.4399999999999999 110.202 179.842 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.646 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 26.8 mp0 . . . . . 0 C--O 1.224 -0.266 0 CA-C-O 120.623 0.249 . . . . 2.4199999999999999 110.985 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.604 ' O ' HD13 ' A' ' 8' ' ' LEU . 19.3 m -72.45 -23.66 61.09 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 111.683 0.253 . . . . 1.25 111.683 -174.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.943 ' HA ' HD22 ' A' ' 8' ' ' LEU . 6.3 p30 -65.16 -22.43 66.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.763 0.316 . . . . 1.78 110.434 175.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.646 ' HB2' ' O ' ' A' ' 3' ' ' GLN . 0.6 OUTLIER -58.55 -53.15 61.59 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 115.949 -0.569 . . . . 1.3999999999999999 110.133 173.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -56.23 -49.11 75.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.184 -0.916 . . . . 0.68000000000000005 110.733 -178.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.943 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.6 OUTLIER -47.49 -44.19 25.2 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.499 -0.773 . . . . 1.1599999999999999 111.056 176.385 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.529 HG13 ' HE2' ' A' ' 130' ' ' MET . 72.9 t -70.79 -64.05 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.296 0.57 . . . . 0.27000000000000002 110.548 175.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.593 HG23 ' O ' ' A' ' 6' ' ' ARG . 48.8 t -51.83 -48.49 38.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 114.906 -1.043 . . . . 0.33000000000000002 112.676 -174.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -56.03 -38.06 70.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.291 -0.413 . . . . 0.58999999999999997 110.679 -178.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.646 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 47.6 t80 -74.33 -45.01 50.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.136 -0.483 . . . . 1.6100000000000001 110.964 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.726 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.8 mp -57.67 -44.06 85.49 Favored 'General case' 0 C--N 1.338 0.083 0 C-N-CA 120.386 -0.525 . . . . 0.34000000000000002 109.846 178.514 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 m -58.48 -40.47 82.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.47 0.652 . . . . 1.05 110.675 177.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -73.67 -17.99 61.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.299 -0.864 . . . . 1.22 111.215 -174.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.668 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.0 mmpt? -88.52 -47.75 8.09 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-O 121.5 0.667 . . . . 1.4099999999999999 110.32 -178.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.6 HD21 ' SG ' ' A' ' 111' ' ' CYS . 13.4 mt -57.41 -30.8 65.25 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 115.258 -0.883 . . . . 1.3500000000000001 111.335 177.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.5 t -57.24 -47.78 80.49 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.112 -0.495 . . . . 0.93999999999999995 111.409 177.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -74.14 1.4 11.29 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.931 0.396 . . . . 1.3700000000000001 111.854 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.627 ' HE2' HG11 ' A' ' 112' ' ' VAL . 15.3 mmmt -110.49 -26.74 9.34 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.953 0.883 . . . . 2.2000000000000002 109.172 178.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.72 26.3 7.23 Favored Glycine 0 N--CA 1.443 -0.833 0 CA-C-N 114.014 -1.448 . . . . 0.53000000000000003 111.921 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -122.59 167.19 13.7 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.851 0.358 . . . . 0.76000000000000001 110.831 174.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.9 t -110.55 151.19 27.9 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.897 -0.592 . . . . 0.52000000000000002 110.003 177.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -72.67 -51.1 20.85 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.08 -0.509 . . . . 3.3599999999999999 109.759 172.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.1 p -61.72 -40.61 95.69 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.68 -0.691 . . . . 1.3700000000000001 111.596 -171.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -55.74 -31.0 62.15 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.103 0.478 . . . . 1.1100000000000001 111.33 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.409 ' O ' ' HB2' ' A' ' 124' ' ' SER . 67.1 m-85 -114.14 16.05 18.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.937 -0.574 . . . . 1.28 111.125 -176.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.619 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 59.8 p -100.97 -179.68 4.12 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.739 0.781 . . . . 1.8100000000000001 112.359 -175.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.58 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 6.9 t70 -163.91 -24.44 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 113.934 -1.485 . . . . 2.3100000000000001 108.142 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.926 HG23 ' H ' ' A' ' 31' ' ' GLU . 9.9 m -57.91 -72.88 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 113.884 -1.507 . . . . 0.92000000000000004 112.874 -177.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.926 ' H ' HG23 ' A' ' 30' ' ' VAL . 14.5 mm-40 -86.59 -0.05 55.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.543 -0.91 . . . . 2.7400000000000002 108.543 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.58 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.1 tt0 . . . . . 0 N--CA 1.445 -0.724 0 CA-C-N 114.663 -1.153 . . . . 1.45 110.182 178.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.821 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.5 t . . . . . 0 CA--C 1.539 0.545 0 CA-C-O 120.496 0.189 . . . . 1.1200000000000001 110.586 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.821 ' H ' HG23 ' A' ' 41' ' ' THR . 12.8 pt-20 -93.1 -29.99 15.49 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 122.545 1.164 . . . . 2.02 108.692 168.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.702 ' HA ' HG13 ' A' ' 46' ' ' VAL . 3.7 p -60.06 -27.13 66.71 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 112.717 -2.038 . . . . 1.25 113.599 -170.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -46.17 -54.15 9.2 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 111.8 0.296 . . . . 1.9099999999999999 111.8 -176.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.99 -41.76 61.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.555 0.217 . . . . 0.52000000000000002 111.521 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.702 HG13 ' HA ' ' A' ' 43' ' ' SER . 0.5 OUTLIER -70.19 -37.15 70.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.896 -0.322 . . . . 1.4099999999999999 111.29 -174.787 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.568 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 8.4 ptpt -68.12 -36.38 79.63 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.4 -0.963 . . . . 0.67000000000000004 108.4 176.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.498 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 3.8 mm100 -63.79 -38.84 92.61 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.195 -0.911 . . . . 0.98999999999999999 110.619 178.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.689 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -74.0 -41.38 61.97 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.183 0.516 . . . . 0.41999999999999998 110.632 176.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.45 HD22 ' HA ' ' A' ' 50' ' ' LEU . 0.1 OUTLIER -54.6 -43.53 72.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.092 -0.958 . . . . 1.3300000000000001 111.687 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.568 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 7.9 ptp180 -74.58 -26.16 59.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.179 0.514 . . . . 2.1699999999999999 110.026 -170.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.498 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 5.3 mm-40 -74.17 -51.46 15.44 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.898 -1.046 . . . . 1.1000000000000001 110.077 178.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.32 -42.13 99.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.517 -0.765 . . . . 0.53000000000000003 110.19 177.075 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.613 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -64.74 -38.29 95.43 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.584 -0.735 . . . . 0.69999999999999996 111.95 176.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.431 ' HA ' ' OE2' ' A' ' 58' ' ' GLU . 14.7 t70 -57.59 -54.14 50.2 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 122.337 0.255 . . . . 1.04 110.496 177.039 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.538 ' HA ' HD11 ' A' ' 59' ' ' LEU . 48.0 mt-10 -56.99 -27.72 61.72 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 123.847 0.717 . . . . 2.29 111.569 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -72.98 -30.67 63.98 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.929 -0.578 . . . . 2.29 110.921 177.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 41.0 mt-10 -70.47 -70.27 0.31 Allowed 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 112.18 0.437 . . . . 1.3 112.18 -173.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.674 HD22 ' N ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -55.6 -34.52 64.93 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.083 0.468 . . . . 1.54 111.457 -174.661 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.674 ' N ' HD22 ' A' ' 59' ' ' LEU . 7.3 ttm180 -53.04 -66.39 0.39 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.337 -0.847 . . . . 2.5800000000000001 111.676 176.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -94.22 -0.23 55.27 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.161 0.8 . . . . 5.3200000000000003 113.161 -172.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.479 ' HA ' ' CD2' ' A' ' 65' ' ' PHE . 3.0 tmt_? -43.69 -38.41 3.11 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.38 0.672 . . . . 4.4800000000000004 112.272 -176.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 67.1 mtt180 -46.39 -50.36 16.68 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.111 0.481 . . . . 4.7199999999999998 110.551 176.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.453 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -71.91 -47.76 50.34 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 115.609 -0.723 . . . . 1.1699999999999999 110.854 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.479 ' CD2' ' HA ' ' A' ' 62' ' ' ARG . 17.9 m-85 -45.9 -48.65 16.12 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.905 0.706 . . . . 2.8100000000000001 112.905 -172.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . 0.412 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 27.8 t -62.46 -38.28 89.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.111 0.481 . . . . 2.1899999999999999 110.894 -177.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -81.21 -31.58 33.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.183 0.516 . . . . 2.7200000000000002 110.479 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 64' ' ' ALA . 1.8 mp -60.64 -17.66 48.65 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.309 -0.859 . . . . 1.5600000000000001 112.296 -177.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.73 HG22 HG13 ' A' ' 74' ' ' ILE . 3.4 p -55.83 -25.43 41.79 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.165 0.439 . . . . 0.69999999999999996 110.926 177.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.5 t -74.35 -37.24 63.56 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.266 0.555 . . . . 1.3400000000000001 109.535 175.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -72.36 -40.89 67.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.321 -0.854 . . . . 1.4199999999999999 110.37 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.432 ' O ' ' HB3' ' A' ' 73' ' ' HIS . 3.1 mm? -68.25 -34.31 75.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.641 -0.503 . . . . 1.3700000000000001 109.641 170.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.432 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 85.9 t60 71.11 0.76 3.54 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.586 -0.734 . . . . 2.7200000000000002 109.844 -171.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.73 HG13 HG22 ' A' ' 69' ' ' THR . 31.6 mm 20.12 -85.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 126.0 1.72 . . . . 0.91000000000000003 114.256 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.891 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER 23.14 -160.87 0.0 OUTLIER Pre-proline 0 CA--C 1.588 2.423 0 C-N-CA 125.033 1.333 . . . . 0.51000000000000001 113.513 -173.927 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.891 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 76.2 Cg_exo -28.13 165.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 125.267 3.978 . . . . 0.46999999999999997 117.281 169.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -34.68 -20.9 0.01 OUTLIER Glycine 0 C--N 1.347 1.153 0 N-CA-C 117.627 1.811 . . . . 0.40000000000000002 117.627 -173.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.438 ' N ' ' O ' ' A' ' 76' ' ' PRO . 38.2 p -66.69 0.91 2.04 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 117.97 0.885 . . . . 0.56000000000000005 111.481 178.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.512 ' HB2' ' O ' ' A' ' 74' ' ' ILE . . . -67.91 -14.72 63.19 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.987 -0.552 . . . . 0.34000000000000002 110.272 172.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -78.31 -21.01 50.29 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.367 -0.605 . . . . 4.1299999999999999 109.367 176.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.544 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 41.9 mt-30 -81.86 -25.87 34.71 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.006 0.908 . . . . 1.03 109.387 172.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.488 ' OG ' ' HA ' ' A' ' 79' ' ' ALA . 2.3 m -72.23 -54.22 10.26 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.344 -1.298 . . . . 0.47999999999999998 109.743 173.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.48 ' HE2' ' CE1' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -62.41 -19.5 63.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.887 -1.051 . . . . 1.1799999999999999 110.213 176.21 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.602 ' HA ' HG12 ' A' ' 87' ' ' VAL . 37.2 tt0 -63.39 -51.6 65.17 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.043 -0.981 . . . . 0.80000000000000004 111.027 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -50.03 -33.05 16.94 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.076 -0.965 . . . . 1.6200000000000001 110.82 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.686 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -83.13 -51.65 14.19 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.04 0 CA-C-N 114.605 -1.179 . . . . 1.3 110.725 -177.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.602 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.8 p -61.64 -22.38 28.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.888 0.851 . . . . 0.84999999999999998 109.378 -178.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.577 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.7 m-80 -68.07 -51.72 43.35 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 114.142 -1.39 . . . . 0.91000000000000003 110.912 173.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.976 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.9 OUTLIER -65.45 -37.31 86.5 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 121.763 0.792 . . . . 2.8700000000000001 108.872 -178.932 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.624 ' HG ' ' CD ' ' A' ' 89' ' ' GLU . 21.1 mt -67.17 -19.22 65.55 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 113.907 -1.497 . . . . 1.28 112.591 -167.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.735 ' HA ' HG22 ' A' ' 95' ' ' VAL . 2.7 p90 -109.94 -19.7 13.01 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.78 -0.368 . . . . 2.2999999999999998 111.878 -174.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.577 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.0 OUTLIER -100.98 -22.53 14.74 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.255 -0.578 . . . . 5.0599999999999996 111.253 -177.984 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -96.15 21.19 9.18 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.822 -0.626 . . . . 3.1200000000000001 111.345 -169.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 112.82 67.62 0.51 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 118.291 -1.909 . . . . 2.3100000000000001 114.059 175.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.735 HG22 ' HA ' ' A' ' 91' ' ' PHE . 38.8 t -70.33 95.63 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.465 0 CA-C-O 122.67 1.224 . . . . 1.0600000000000001 110.928 -177.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.656 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 0.2 OUTLIER -110.2 179.21 4.16 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 113.095 -1.866 . . . . 2.1200000000000001 107.252 167.618 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.606 ' HB3' ' CD2' ' A' ' 151' ' ' PHE . 12.7 m-90 -51.87 -44.06 63.55 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 123.411 0.444 . . . . 3.3399999999999999 111.529 -176.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -62.71 -33.14 85.89 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 114.662 0.625 . . . . 0.68999999999999995 114.662 -176.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.656 ' HG2' ' ND2' ' A' ' 96' ' ' ASN . 81.5 mmt-85 -60.93 -38.72 86.79 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 117.632 0.716 . . . . 4.2400000000000002 110.38 -178.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.595 HG12 ' HG ' ' A' ' 138' ' ' LEU . 81.4 mt -75.17 -35.4 34.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 115.196 -0.911 . . . . 0.44 111.281 -173.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.4 m -65.88 -33.78 65.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.549 -0.537 . . . . 1.3500000000000001 109.549 173.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.51 -48.04 71.05 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.218 0.532 . . . . 0.44 109.603 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.48 ' CE1' ' HE2' ' A' ' 83' ' ' PHE . 42.8 t80 -50.48 -53.2 31.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.47 -1.241 . . . . 1.49 111.931 178.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.527 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 0.2 OUTLIER -80.08 -20.23 45.63 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.395 -0.522 . . . . 3.29 111.081 -175.027 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.646 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 31.3 t -75.01 -53.02 9.65 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.63 0.252 . . . . 1.1899999999999999 110.382 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.521 ' CZ ' ' HB ' ' A' ' 86' ' ' VAL . 2.3 p90 -68.23 -22.08 64.8 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 109.599 -0.519 . . . . 2.8900000000000001 109.599 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.464 ' HA2' ' HB2' ' A' ' 110' ' ' LEU . . . -75.07 -40.87 33.67 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.687 -0.768 . . . . 0.29999999999999999 111.507 174.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.726 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -64.57 -33.98 88.69 Favored Glycine 0 N--CA 1.448 -0.5 0 N-CA-C 110.916 -0.874 . . . . 0.23000000000000001 110.916 174.246 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.95 -29.23 58.22 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.532 -0.334 . . . . 0.31 110.449 173.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.464 ' HB2' ' HA2' ' A' ' 107' ' ' GLY . 0.2 OUTLIER -62.73 -39.67 94.79 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 107.758 -1.201 . . . . 1.1200000000000001 107.758 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.727 ' SG ' HG22 ' A' ' 123' ' ' VAL . 41.1 t -48.69 -60.32 2.82 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 113.362 -1.744 . . . . 0.26000000000000001 109.554 171.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.924 ' HA ' HG13 ' A' ' 115' ' ' VAL . 46.0 t -66.38 -31.65 54.54 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 CA-C-N 116.366 -0.379 . . . . 0.34999999999999998 111.859 -178.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.533 ' O ' HG21 ' A' ' 74' ' ' ILE . 22.5 mt-10 -57.52 -20.72 33.42 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 118.28 0.491 . . . . 2.5099999999999998 110.321 176.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.519 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 50.1 m -89.54 -44.93 9.76 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 108.465 -0.939 . . . . 0.28000000000000003 108.465 179.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.924 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.4 m -67.86 -29.07 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.106 0 CA-C-N 115.061 -0.972 . . . . 1.23 109.623 -177.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -51.56 -50.62 59.73 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 113.379 -1.737 . . . . 0.59999999999999998 111.169 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt -86.15 13.57 7.65 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.695 -0.684 . . . . 1.6200000000000001 109.811 178.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.633 ' HA ' HE21 ' A' ' 120' ' ' GLN . 23.9 mm-40 63.57 53.54 2.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 122.016 0.912 . . . . 1.8799999999999999 110.571 -177.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.554 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 27.1 mtm -132.27 39.83 3.37 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.197 -1.365 . . . . 0.31 107.457 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.661 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 3.9 mp0 -53.54 -6.82 0.08 Allowed 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 114.685 -1.143 . . . . 1.1499999999999999 113.18 -178.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.563 HG23 HD22 ' A' ' 122' ' ' LEU . 21.1 m -67.71 -29.01 43.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.588 -0.695 . . . . 0.46000000000000002 111.973 175.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.563 HD22 HG23 ' A' ' 121' ' ' VAL . 3.8 mm? -65.06 -27.27 68.67 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.02 0.438 . . . . 0.26000000000000001 110.294 178.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.727 HG22 ' SG ' ' A' ' 111' ' ' CYS . 39.8 t -44.13 -46.4 2.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 114.384 -1.28 . . . . 0.25 112.165 -177.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.619 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 23.0 t -73.83 -43.28 59.22 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.325 -0.398 . . . . 1.3500000000000001 111.743 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.452 ' HD3' HD12 ' A' ' 122' ' ' LEU . 8.6 ptm180 -72.24 -36.87 69.19 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.966 -0.293 . . . . 2.6699999999999999 110.264 -170.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.577 HD12 ' HA ' ' A' ' 111' ' ' CYS . 82.4 mt -55.45 -49.58 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.642 -0.254 . . . . 0.23000000000000001 111.323 174.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.563 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.2 -30.5 66.51 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.767 0.318 . . . . 0.28999999999999998 111.478 -178.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.09 -60.66 3.28 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.395 0.617 . . . . 0.28000000000000003 110.193 175.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.416 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 98.5 m95 -57.75 -41.8 82.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.648 -1.16 . . . . 3.9100000000000001 111.045 -178.071 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.529 ' HE2' HG13 ' A' ' 9' ' ' VAL . 87.5 mtp -59.11 -57.74 11.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.457 -0.338 . . . . 1.0800000000000001 111.416 -178.247 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.1 74.87 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.872 -0.331 . . . . 0.25 110.87 -177.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.421 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 22.4 m -68.02 -45.18 74.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.852 0.358 . . . . 0.40000000000000002 111.458 176.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.61 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 13.0 m-85 -63.78 -33.29 75.33 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.896 -0.321 . . . . 3.1299999999999999 110.422 177.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.819 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.7 tt -64.43 -50.95 65.58 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 108.354 -0.98 . . . . 0.94999999999999996 108.354 170.079 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . 0.421 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 2.3 m-80 -49.02 -60.83 2.44 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.651 0.611 . . . . 0.46000000000000002 112.651 -179.366 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -78.51 -44.91 23.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.931 0.396 . . . . 0.58999999999999997 111.941 -172.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . 0.61 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 14.5 m80 -90.54 -51.41 5.41 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.857 0.688 . . . . 1.45 112.857 -170.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.819 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -85.37 -47.07 10.35 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 113.932 1.086 . . . . 1.2 113.932 -168.844 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.694 ' HA ' HD12 ' A' ' 142' ' ' ILE . 37.7 tt0 -45.48 -52.72 21.56 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 112.891 0.7 . . . . 0.75 112.891 -173.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.596 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 51.5 Cg_exo -53.44 -48.97 19.08 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.717 1.612 . . . . 0.56000000000000005 111.522 177.023 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -61.26 -46.1 91.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.332 -0.849 . . . . 1.2 110.339 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.694 HD12 ' HA ' ' A' ' 139' ' ' GLU . 37.5 mt -48.46 -51.25 11.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.073 0.464 . . . . 0.32000000000000001 111.117 175.264 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.595 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 74.7 mm-40 -59.14 -32.92 70.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.453 -0.794 . . . . 0.56999999999999995 111.485 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 12.3 mm-40 -64.59 -21.13 66.62 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.585 0.707 . . . . 0.78000000000000003 110.871 177.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -106.76 11.86 29.75 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.0 -1.0 . . . . 0.93000000000000005 109.54 -175.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 113.62 -35.02 4.73 Favored Glycine 0 N--CA 1.439 -1.122 0 CA-C-N 114.525 -1.216 . . . . 0.56000000000000005 112.895 174.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 124.46 -170.86 16.57 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.664 -0.779 . . . . 0.48999999999999999 111.691 -177.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.542 ' NE1' HD13 ' A' ' 142' ' ' ILE . 4.4 m-90 -78.54 -33.46 47.84 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.565 0.221 . . . . 3.5699999999999998 111.099 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -65.28 -41.71 93.88 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.922 0.391 . . . . 1.96 110.309 178.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.462 ' O ' ' HB2' ' A' ' 153' ' ' GLU . 88.2 m -56.94 -35.85 69.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.868 -0.605 . . . . 0.67000000000000004 111.197 177.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.606 ' CD2' ' HB3' ' A' ' 97' ' ' TRP . 53.5 t80 -58.92 -41.97 88.58 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.216 -0.447 . . . . 3.0 110.552 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.522 HG12 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -72.81 -25.75 22.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.098 0.475 . . . . 1.1499999999999999 110.304 -179.039 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 150' ' ' THR . 62.0 mm-40 -60.81 -23.21 64.88 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.033 0.444 . . . . 1.6699999999999999 110.551 173.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.525 ' HB2' ' CD1' ' A' ' 155' ' ' TYR . 0.5 OUTLIER -105.5 -54.27 2.51 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.887 -0.597 . . . . 1.3 110.956 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . 0.525 ' CD1' ' HB2' ' A' ' 154' ' ' LEU . 88.8 m-85 -110.61 14.51 22.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.643 -0.708 . . . . 4.2400000000000002 111.242 -171.153 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.689 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -59.76 158.93 23.2 Favored Glycine 0 CA--C 1.504 -0.643 0 C-N-CA 121.251 -0.5 . . . . 1.1000000000000001 113.629 -175.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 . . . . . 0 C--N 1.316 -0.851 0 CA-C-N 113.94 -1.13 . . . . 1.29 110.947 178.751 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . 0.641 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.532 1.14 0 CA-C-O 120.942 0.19 . . . . 1.2 113.037 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -85.32 -47.8 9.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.103 0.478 . . . . 2.8799999999999999 111.165 171.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -82.68 -52.74 6.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.829 -0.623 . . . . 1.3100000000000001 112.543 -168.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . . . . . . . . . 3.9 mm? -59.58 -58.56 8.04 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 123.172 0.295 . . . . 1.3300000000000001 110.542 -176.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 0.976 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -32.35 -53.63 0.31 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 122.186 0.993 . . . . 0.88 112.059 170.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -68.69 -55.19 12.23 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 113.816 -1.538 . . . . 1.03 111.877 -176.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -64.7 -23.27 67.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.199 -0.455 . . . . 1.6699999999999999 111.048 -178.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -72.19 -6.66 65.39 Favored Glycine 0 N--CA 1.446 -0.669 0 CA-C-N 116.006 -0.543 . . . . 0.78000000000000003 112.831 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -80.87 -2.26 46.69 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 111.757 0.28 . . . . 1.8999999999999999 111.757 177.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 2.4 m . . . . . 0 CA--C 1.53 0.191 0 O-C-N 121.793 -0.567 . . . . 1.4399999999999999 111.419 -174.03 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.63 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 43.7 tp60 . . . . . 0 N--CA 1.455 -0.203 0 CA-C-O 121.264 0.554 . . . . 2.4199999999999999 109.69 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.5 p -76.33 -16.21 59.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.805 -0.634 . . . . 1.25 110.249 177.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.814 ' HB3' HD13 ' A' ' 134' ' ' LEU . 51.5 m-20 -66.81 -19.82 65.82 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.462 -0.57 . . . . 1.78 109.462 175.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.63 ' HB2' ' O ' ' A' ' 3' ' ' GLN . 2.5 mmt85 -51.01 -51.02 57.22 Favored 'General case' 0 CA--C 1.509 -0.607 0 CA-C-N 115.417 -0.811 . . . . 1.3999999999999999 110.522 176.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.438 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 43.5 mt-10 -56.38 -47.2 79.42 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.172 -0.922 . . . . 0.68000000000000005 111.163 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.764 HD22 ' HA ' ' A' ' 5' ' ' ASN . 1.2 mp -51.44 -31.58 23.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.508 -0.769 . . . . 1.1599999999999999 111.21 176.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.454 HG21 ' CA ' ' A' ' 131' ' ' ALA . 77.9 t -83.1 -67.05 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.55 0.691 . . . . 0.27000000000000002 110.531 172.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 6' ' ' ARG . 51.1 t -50.28 -55.26 6.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.656 -1.156 . . . . 0.33000000000000002 113.515 -172.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -50.73 -33.33 22.55 Favored 'General case' 0 C--O 1.234 0.246 0 O-C-N 123.635 0.584 . . . . 0.58999999999999997 111.364 -174.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.651 ' HE1' ' HB3' ' A' ' 51' ' ' ARG . 98.9 m-85 -90.37 -35.57 15.12 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.838 -0.619 . . . . 1.6100000000000001 112.37 -175.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 1.053 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 2.6 mp -60.12 -37.57 80.41 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 119.368 -0.933 . . . . 0.34000000000000002 108.93 174.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.452 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 39.8 t -58.75 -44.98 90.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.278 -0.873 . . . . 1.05 110.68 175.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -66.9 -33.92 76.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.072 -0.513 . . . . 1.22 110.702 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.63 ' HG2' ' O ' ' A' ' 12' ' ' PHE . 8.5 mmpt? -68.97 -33.24 73.37 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.434 -0.348 . . . . 1.4099999999999999 110.962 -178.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.628 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -73.2 -30.02 63.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.876 0.37 . . . . 1.3500000000000001 110.434 176.447 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.6 t -62.44 -36.15 81.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.911 -0.586 . . . . 0.93999999999999995 111.4 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -77.07 -1.91 31.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 1.3700000000000001 111.664 -179.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.594 ' HE2' HG11 ' A' ' 112' ' ' VAL . 15.6 mmmt -111.75 -26.21 9.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.872 0.844 . . . . 2.2000000000000002 109.227 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.69 23.14 8.96 Favored Glycine 0 N--CA 1.441 -0.982 0 CA-C-N 113.978 -1.465 . . . . 0.53000000000000003 111.719 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.484 ' HE2' HE21 ' A' ' 120' ' ' GLN . 50.0 m-85 -113.66 164.69 13.36 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.023 -0.362 . . . . 0.76000000000000001 110.023 175.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.607 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 2.1 t -111.57 143.68 42.06 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.975 -0.557 . . . . 0.52000000000000002 109.833 176.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.452 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.8 OUTLIER -66.5 -48.75 68.82 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.229 -0.441 . . . . 3.3599999999999999 110.117 174.631 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.484 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 3.9 p -64.36 -27.84 69.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.5 . . . . 1.3700000000000001 111.919 -174.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.607 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 94.7 mt-30 -57.36 -33.65 68.01 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.203 0.525 . . . . 1.1100000000000001 110.989 176.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.411 ' O ' ' HB2' ' A' ' 124' ' ' SER . 62.3 m-85 -120.09 14.86 12.34 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.604 -0.726 . . . . 1.28 111.319 -170.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.579 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 72.5 p -100.98 179.89 4.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 122.074 0.94 . . . . 1.8100000000000001 112.94 -172.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.598 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 21.4 t70 -168.69 -20.28 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 113.182 -1.827 . . . . 2.3100000000000001 107.933 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.884 HG23 ' H ' ' A' ' 31' ' ' GLU . 5.8 m -57.51 -71.8 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 114.171 -1.377 . . . . 0.92000000000000004 112.669 -176.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.884 ' H ' HG23 ' A' ' 30' ' ' VAL . 24.2 mm-40 -87.82 -2.92 58.92 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.668 -0.864 . . . . 2.7400000000000002 108.668 177.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.598 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 34.6 tt0 . . . . . 0 N--CA 1.437 -1.104 0 CA-C-N 114.6 -1.182 . . . . 1.45 109.378 -179.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 N--CA 1.444 -0.756 0 N-CA-C 113.19 0.811 . . . . 1.1200000000000001 113.19 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -29.3 -32.55 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.713 1.205 . . . . 2.02 113.454 169.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.724 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 2.7 p -30.74 -49.03 0.12 Allowed 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 114.228 1.196 . . . . 1.25 114.228 -177.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -40.27 -50.93 2.76 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.748 0.648 . . . . 1.9099999999999999 112.748 -173.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.39 -36.38 58.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.697 0.284 . . . . 0.52000000000000002 111.519 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.577 ' HA ' HG12 ' A' ' 152' ' ' VAL . 1.0 OUTLIER -74.25 -39.05 49.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.632 -0.258 . . . . 1.4099999999999999 111.344 -175.011 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.724 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.0 ptpt -67.37 -44.43 78.97 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.993 -0.743 . . . . 0.67000000000000004 108.993 174.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.451 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 3.6 mm100 -54.12 -35.18 61.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.724 -0.671 . . . . 0.98999999999999999 112.038 174.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.627 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -80.66 -30.94 36.52 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.105 0.479 . . . . 0.41999999999999998 111.036 177.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.612 ' HG ' ' CE2' ' A' ' 104' ' ' PHE . 1.1 mp -68.34 -26.92 65.84 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.707 -0.679 . . . . 1.3300000000000001 111.744 -176.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.651 ' HB3' ' HE1' ' A' ' 12' ' ' PHE . 5.3 ptp180 -80.83 -26.6 36.95 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.57 0.7 . . . . 2.1699999999999999 109.26 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -71.5 -54.33 10.92 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.592 -1.186 . . . . 1.1000000000000001 109.707 177.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.36 -39.31 93.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.724 -0.671 . . . . 0.53000000000000003 110.454 176.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.701 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -58.22 -51.92 55.66 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.666 -0.697 . . . . 0.69999999999999996 112.003 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.552 ' O ' HD22 ' A' ' 59' ' ' LEU . 17.8 t70 -53.33 -40.89 65.2 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.956 0.408 . . . . 1.04 111.226 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.523 ' O ' HD21 ' A' ' 59' ' ' LEU . 44.2 mt-10 -75.27 -25.34 57.93 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.453 -0.794 . . . . 2.29 111.645 -179.018 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.902 ' HZ ' ' HA2' ' B' 1012 ' ' GLY . 8.0 t80 -85.38 -46.95 10.46 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.74 0.644 . . . . 2.29 112.74 178.456 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.701 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 44.8 mt-10 -54.86 -52.12 63.81 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.737 0.643 . . . . 1.3 112.737 -166.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.581 HD23 ' N ' ' A' ' 59' ' ' LEU . 2.2 pt? -52.15 -34.25 43.94 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.196 -0.911 . . . . 1.54 111.697 -174.327 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 -55.35 -55.15 34.81 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.466 -0.334 . . . . 2.5800000000000001 111.154 -178.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.613 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 47.4 p90 -93.03 -3.58 54.09 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.242 -0.435 . . . . 5.3200000000000003 111.775 -178.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.632 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 41.6 ttm180 -50.87 -36.04 35.78 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.746 0.647 . . . . 4.4800000000000004 112.746 -173.113 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -61.81 -31.59 71.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.605 0.24 . . . . 4.7199999999999998 111.512 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.638 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.06 -47.8 7.6 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.567 0.58 . . . . 1.1699999999999999 112.567 -174.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.632 ' CD1' ' HA ' ' A' ' 62' ' ' ARG . 5.7 p90 -58.47 -27.09 64.09 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.703 0.631 . . . . 2.8100000000000001 112.703 -166.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.0 t -70.58 -31.59 68.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.151 0.5 . . . . 2.1899999999999999 110.259 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -91.01 -24.96 19.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 2.7200000000000002 111.008 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 59.9 mt -59.76 -16.69 29.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.915 0.709 . . . . 1.5600000000000001 112.915 -174.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.658 HG22 HG13 ' A' ' 74' ' ' ILE . 16.6 p -50.91 -35.89 35.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.113 0.482 . . . . 0.69999999999999996 111.113 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 13.4 t -67.01 -34.72 78.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.402 -0.817 . . . . 1.3400000000000001 110.755 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -78.54 -49.06 13.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.776 -0.647 . . . . 1.4199999999999999 110.289 -177.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.723 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.1 mt -67.06 -30.64 70.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.397 -0.819 . . . . 1.3700000000000001 110.196 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.1 m80 68.58 61.31 0.36 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.922 0.868 . . . . 2.7200000000000002 109.191 -177.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.658 HG13 HG22 ' A' ' 69' ' ' THR . 16.0 mm -64.93 123.54 17.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 114.009 -1.45 . . . . 0.91000000000000003 110.926 -178.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.773 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.1 -169.35 0.22 Allowed Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 107.515 -1.291 . . . . 0.51000000000000001 107.515 -169.872 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.773 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.5 Cg_exo -30.5 166.26 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.272 0 C-N-CA 124.722 3.614 . . . . 0.46999999999999997 114.875 164.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.24 -28.93 0.01 OUTLIER Glycine 0 N--CA 1.476 1.331 0 N-CA-C 117.089 1.596 . . . . 0.40000000000000002 117.089 -175.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.455 ' N ' ' O ' ' A' ' 76' ' ' PRO . 22.1 p -69.27 6.53 0.97 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 117.693 0.747 . . . . 0.56000000000000005 111.695 178.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.3 -14.23 62.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.391 -0.596 . . . . 0.34000000000000002 109.391 169.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -75.48 -16.81 60.27 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.649 -0.705 . . . . 4.1299999999999999 109.348 174.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.491 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 76.5 mt-30 -83.8 -27.01 29.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.947 0.879 . . . . 1.03 109.635 173.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.723 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.8 m -72.1 -52.45 16.74 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.646 -1.161 . . . . 0.47999999999999998 109.187 171.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.438 ' HB2' ' HG ' ' A' ' 110' ' ' LEU . 75.6 t80 -65.03 -16.1 63.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.887 -1.051 . . . . 1.1799999999999999 110.005 174.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.65 ' HA ' HG12 ' A' ' 87' ' ' VAL . 34.1 tt0 -62.95 -50.14 71.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.975 0.416 . . . . 0.80000000000000004 110.288 176.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -44.32 -45.55 8.8 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 114.793 -1.094 . . . . 1.6200000000000001 111.343 179.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.637 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.4 p -90.44 -39.21 11.79 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 CA-C-N 113.42 -1.718 . . . . 1.3 111.77 -171.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.65 HG12 ' HA ' ' A' ' 84' ' ' GLU . 5.3 p -64.86 -23.4 33.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.894 0.854 . . . . 0.84999999999999998 109.063 176.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.1 m-80 -70.49 -46.09 64.4 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.309 -1.314 . . . . 0.91000000000000003 111.345 175.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 1.029 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.7 OUTLIER -69.14 -36.4 77.41 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 108.59 -0.893 . . . . 2.8700000000000001 108.59 -179.222 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.633 HD12 ' HD2' ' A' ' 99' ' ' ARG . 1.1 tp -69.58 -20.16 63.65 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 113.797 -1.547 . . . . 1.28 111.783 -168.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.6 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 2.5 p90 -110.66 -12.3 14.34 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.441 -0.503 . . . . 2.2999999999999998 111.569 -175.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.57 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 9.0 ptm180 -98.46 -35.47 10.25 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.388 0.613 . . . . 5.0599999999999996 110.988 -179.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -82.93 5.05 23.24 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.323 -0.853 . . . . 3.1200000000000001 112.587 -167.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 131.26 67.49 0.1 OUTLIER Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 117.83 -2.129 . . . . 2.3100000000000001 114.724 -177.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.6 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 57.3 t -72.71 95.86 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 122.056 0.931 . . . . 1.0600000000000001 111.307 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -113.19 -171.0 1.79 Allowed 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.425 -1.261 . . . . 2.1200000000000001 108.868 173.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.615 ' HB3' ' HE2' ' A' ' 155' ' ' TYR . 15.7 m-90 -53.39 -54.23 39.77 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 123.475 0.484 . . . . 3.3399999999999999 111.345 -179.544 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.431 ' O ' ' HB ' ' A' ' 101' ' ' VAL . . . -77.17 -16.59 80.47 Favored Glycine 0 CA--C 1.52 0.381 0 C-N-CA 121.093 -0.575 . . . . 0.68999999999999995 113.775 -175.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.649 HH12 ' HA ' ' B' 1009 ' ' ALA . 7.5 tpp180 -67.36 -43.02 82.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.066 0.46 . . . . 4.2400000000000002 110.464 -178.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.421 ' CD1' ' HG ' ' A' ' 138' ' ' LEU . 85.5 mt -69.86 -31.78 49.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.3 0.572 . . . . 0.44 110.488 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.619 ' HA ' ' CD2' ' A' ' 104' ' ' PHE . 59.8 t -52.96 -51.72 35.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.35 -0.841 . . . . 1.3500000000000001 110.352 172.42 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.406 ' HB2' ' CE1' ' A' ' 57' ' ' PHE . . . -55.31 -47.61 75.36 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.657 -0.701 . . . . 0.44 110.841 175.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -57.32 -50.71 72.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.315 -0.857 . . . . 1.49 112.357 -178.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.619 ' CD2' ' HA ' ' A' ' 101' ' ' VAL . 1.2 p90 -66.86 -36.18 81.73 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 120.584 -0.446 . . . . 3.29 110.404 -176.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 44.5 m -68.4 -40.73 81.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.253 -0.43 . . . . 1.1899999999999999 110.501 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -71.56 -34.52 70.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.883 -0.599 . . . . 2.8900000000000001 110.402 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.491 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -62.49 -42.01 99.74 Favored Glycine 0 N--CA 1.444 -0.823 0 C-N-CA 120.367 -0.921 . . . . 0.29999999999999999 110.89 174.271 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 1.053 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.29 -28.32 73.43 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.788 -0.72 . . . . 0.23000000000000001 111.683 174.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.97 -35.12 50.59 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.907 -0.172 . . . . 0.31 110.636 176.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.438 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -59.64 -38.81 82.39 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 107.904 -1.146 . . . . 1.1200000000000001 107.904 178.411 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.781 ' HB2' HD23 ' A' ' 13' ' ' LEU . 26.2 t -49.14 -63.12 1.19 Allowed 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 113.406 -1.725 . . . . 0.26000000000000001 109.824 171.605 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.94 ' HA ' HG13 ' A' ' 115' ' ' VAL . 42.5 t -62.27 -34.52 64.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 0.34999999999999998 111.667 -177.314 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.495 ' C ' HG21 ' A' ' 74' ' ' ILE . 32.8 mt-10 -57.0 -23.51 46.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.055 0.455 . . . . 2.5099999999999998 110.278 178.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.419 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 54.3 m -85.93 -43.62 13.07 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 108.479 -0.934 . . . . 0.28000000000000003 108.479 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.94 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.8 m -69.0 -29.04 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 CA-C-N 114.93 -1.032 . . . . 1.23 109.787 -176.055 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -50.53 -49.93 54.49 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 113.165 -1.834 . . . . 0.59999999999999998 110.995 174.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -86.81 11.19 13.8 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.554 -0.748 . . . . 1.6200000000000001 110.019 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 64.03 52.75 1.98 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 122.146 0.974 . . . . 1.8799999999999999 110.137 -175.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.419 ' CE ' ' HA ' ' A' ' 114' ' ' SER . 30.3 mtm -129.9 36.92 4.0 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.075 -1.42 . . . . 0.31 107.531 179.118 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.78 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 11.7 mp0 -53.84 -7.95 0.15 Allowed 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.637 -1.165 . . . . 1.1499999999999999 113.24 -178.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.51 HG23 HD22 ' A' ' 122' ' ' LEU . 20.9 m -67.06 -20.51 27.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 O-C-N 121.671 -0.643 . . . . 0.46000000000000002 111.997 175.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.699 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -75.05 -25.07 58.38 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.029 0.442 . . . . 0.26000000000000001 110.077 177.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.737 HG22 ' SG ' ' A' ' 111' ' ' CYS . 42.3 t -45.52 -51.87 2.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.617 -1.174 . . . . 0.25 112.355 -177.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.579 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 7.1 t -75.24 -34.27 61.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.884 0.374 . . . . 1.3500000000000001 110.76 -178.38 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.699 ' HD2' HD13 ' A' ' 122' ' ' LEU . 74.2 mtt180 -64.06 -51.39 64.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.445 . . . . 2.6699999999999999 110.591 -176.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.547 HG22 ' SD ' ' A' ' 130' ' ' MET . 73.4 mt -53.97 -50.05 56.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.572 -0.74 . . . . 0.23000000000000001 111.155 178.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -53.73 -36.11 61.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.893 0.378 . . . . 0.28999999999999998 111.517 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -61.5 -56.99 13.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.555 0.693 . . . . 0.28000000000000003 110.674 176.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -65.31 -32.01 73.44 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.809 -1.087 . . . . 3.9100000000000001 111.334 -176.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.547 ' SD ' HG22 ' A' ' 126' ' ' ILE . 90.3 mtp -64.51 -54.29 34.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.907 0.384 . . . . 1.0800000000000001 111.277 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.454 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -61.69 -41.02 97.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.027 -0.533 . . . . 0.25 111.151 -178.026 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 59.7 m -65.73 -43.24 89.65 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.808 -0.357 . . . . 0.40000000000000002 110.782 176.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.582 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 16.7 t80 -56.64 -40.11 74.88 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.707 -0.479 . . . . 3.1299999999999999 109.707 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.865 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.2 tt -61.1 -55.91 27.08 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.827 -0.805 . . . . 0.94999999999999996 108.827 172.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -50.63 -46.86 58.5 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.388 -0.823 . . . . 0.46000000000000002 112.862 -176.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -87.03 -47.43 8.94 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.127 0.489 . . . . 0.58999999999999997 111.8 -174.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . 0.582 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 66.8 m-70 -90.17 -50.89 5.74 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.829 -0.623 . . . . 1.45 112.253 -170.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.865 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -85.07 -44.84 12.66 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 113.555 0.946 . . . . 1.2 113.555 -168.52 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.628 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 29.6 tt0 -45.18 -51.25 25.41 Favored Pre-proline 0 C--N 1.32 -0.701 0 O-C-N 123.699 0.625 . . . . 0.75 112.596 -174.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.581 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 46.5 Cg_exo -55.7 -47.67 24.15 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 121.673 1.582 . . . . 0.56000000000000005 111.591 175.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . 0.439 ' O ' ' HB2' ' A' ' 144' ' ' GLU . 0.1 OUTLIER -57.43 -48.18 79.83 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.507 -0.77 . . . . 1.2 110.387 177.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.618 HD12 ' HA ' ' A' ' 139' ' ' GLU . 19.1 mt -51.54 -49.43 33.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.665 -0.698 . . . . 0.32000000000000001 111.531 175.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.628 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 80.5 mm-40 -60.98 -29.71 69.84 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.773 -0.649 . . . . 0.56999999999999995 111.263 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 13.2 mm-40 -64.57 -20.17 66.08 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 121.439 0.637 . . . . 0.78000000000000003 110.571 174.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.643 ' N ' HD22 ' A' ' 145' ' ' ASN . 0.7 OUTLIER -105.83 3.58 28.84 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.279 -0.873 . . . . 0.93000000000000005 109.517 -175.56 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.15 -30.47 6.76 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.157 -0.929 . . . . 0.56000000000000005 113.229 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . 0.423 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 113.42 159.72 13.65 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.252 -0.739 . . . . 0.48999999999999999 111.252 -175.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.493 ' HB3' ' CB ' ' A' ' 46' ' ' VAL . 81.4 m95 -55.74 -30.77 61.75 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.491 0.552 . . . . 3.5699999999999998 112.491 -174.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.525 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 14.1 p-10 -63.32 -41.29 98.91 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.669 -0.412 . . . . 1.96 109.955 177.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.543 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 54.3 m -65.94 -32.53 74.08 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.841 -0.618 . . . . 0.67000000000000004 110.768 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.706 ' HD2' ' HH ' ' A' ' 155' ' ' TYR . 4.1 m-85 -60.28 -41.94 94.4 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.004 -0.544 . . . . 3.0 110.13 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.577 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -77.09 -25.28 15.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.155 0.503 . . . . 1.1499999999999999 110.233 177.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 8.9 mm-40 -58.74 -20.82 52.68 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 121.967 -0.458 . . . . 1.6699999999999999 110.124 173.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 150' ' ' THR . 2.6 mt -99.36 -55.62 2.63 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.884 -0.598 . . . . 1.3 110.419 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . 0.706 ' HH ' ' HD2' ' A' ' 151' ' ' PHE . 26.8 p90 -121.89 30.24 6.74 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.626 0.727 . . . . 4.2400000000000002 112.402 -173.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.627 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -66.52 163.58 42.96 Favored Glycine 0 C--N 1.303 -1.291 0 CA-C-N 114.804 -1.089 . . . . 1.1000000000000001 113.738 -177.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.423 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 28.5 t-20 . . . . . 0 C--N 1.314 -0.976 0 CA-C-N 113.604 -1.298 . . . . 1.29 112.088 -177.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 1.389 0 N-CA-C 113.981 0.353 . . . . 1.2 113.981 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -107.21 -44.73 4.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 117.329 0.564 . . . . 2.8799999999999999 112.446 175.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . 0.41 ' HB3' HD12 ' B' 1008 ' ' LEU . . . -58.57 -64.24 1.0 Allowed 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 113.046 0.758 . . . . 1.3100000000000001 113.046 -165.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.699 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 4.3 mp -71.0 -36.09 72.33 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-N 116.514 -0.312 . . . . 1.3300000000000001 110.352 -172.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 1.029 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -42.28 -45.21 4.12 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.38 -0.827 . . . . 0.88 110.245 168.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -77.16 -40.41 45.54 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.463 -1.244 . . . . 1.03 111.681 -178.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -74.6 -30.27 61.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.784 0.326 . . . . 1.6699999999999999 111.312 -177.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . 0.902 ' HA2' ' HZ ' ' A' ' 57' ' ' PHE . . . -71.63 -11.45 72.81 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 116.07 -0.514 . . . . 0.78000000000000003 112.79 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.88 -17.11 60.63 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.171 0.51 . . . . 1.8999999999999999 110.311 174.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 9.4 m . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 121.291 0.567 . . . . 1.4399999999999999 110.304 -178.793 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 . . . . . 0 CA--C 1.529 0.167 0 N-CA-C 111.966 0.358 . . . . 2.4199999999999999 111.966 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -60.1 -24.35 64.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.133 -0.485 . . . . 1.25 111.273 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.544 ' HB2' HD13 ' A' ' 134' ' ' LEU . 6.2 p30 -57.45 -30.08 64.73 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.898 -0.592 . . . . 1.78 111.601 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.438 ' O ' HG23 ' A' ' 10' ' ' VAL . 18.5 tpp85 -55.51 -49.92 71.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.895 -0.593 . . . . 1.3999999999999999 110.959 178.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -60.71 -43.13 98.21 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.679 -0.691 . . . . 0.68000000000000005 111.596 -176.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.567 HD21 ' HB3' ' A' ' 43' ' ' SER . 4.8 mt -63.3 -34.84 78.57 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.237 -0.892 . . . . 1.1599999999999999 109.534 -175.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.511 HG13 ' HE2' ' A' ' 130' ' ' MET . 53.4 t -68.63 -63.83 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 115.51 -0.768 . . . . 0.27000000000000002 109.586 173.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 6' ' ' ARG . 97.9 t -49.55 -55.06 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.371 -0.831 . . . . 0.33000000000000002 113.033 -176.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -57.66 -33.25 68.12 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.201 0.313 . . . . 0.58999999999999997 111.067 -173.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.667 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 20.4 t80 -83.64 -39.32 20.41 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 120.573 -0.451 . . . . 1.6100000000000001 111.464 -177.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.992 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.0 mp -58.04 -40.34 80.68 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 119.666 -0.813 . . . . 0.34000000000000002 109.286 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.443 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 47.8 t -60.08 -41.72 93.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.428 -0.806 . . . . 1.05 110.548 175.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -66.08 -30.47 70.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.908 -0.587 . . . . 1.22 110.935 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.825 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 14.8 mmmt -73.05 -48.67 34.0 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 121.453 0.644 . . . . 1.4099999999999999 109.852 -178.378 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.639 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . 10.8 mt -56.54 -33.27 65.92 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.516 -0.765 . . . . 1.3500000000000001 111.002 172.339 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.8 t -68.23 -24.81 64.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.876 -0.602 . . . . 0.93999999999999995 111.893 -178.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.825 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 23.2 pt20 -77.18 -16.65 59.02 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-O 121.395 0.617 . . . . 1.3700000000000001 110.304 -177.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.696 ' HD2' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -105.04 -24.62 12.78 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.943 -1.026 . . . . 2.2000000000000002 109.365 -179.364 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.04 23.14 8.74 Favored Glycine 0 N--CA 1.439 -1.115 0 CA-C-N 114.189 -1.369 . . . . 0.53000000000000003 112.936 176.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -99.22 164.58 12.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.737 0.304 . . . . 0.76000000000000001 110.295 172.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.1 t -103.22 148.28 25.99 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.145 0.497 . . . . 0.52000000000000002 110.671 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.651 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 58.3 t-105 -75.53 -54.26 7.29 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.433 -0.803 . . . . 3.3599999999999999 109.557 174.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.1 m -62.4 -32.8 73.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.703 -0.68 . . . . 1.3700000000000001 111.948 -173.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -60.29 -28.83 68.4 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 111.921 0.341 . . . . 1.1100000000000001 111.921 -178.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -117.27 -2.44 11.61 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.222 0.453 . . . . 1.28 112.222 -175.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.628 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 51.5 m -102.04 155.48 18.15 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-O 122.155 0.978 . . . . 1.8100000000000001 113.181 -175.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -130.79 -0.22 4.29 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 113.321 -1.763 . . . . 2.3100000000000001 109.163 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.888 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.9 m -59.99 -75.68 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.434 -1.257 . . . . 0.92000000000000004 113.239 -167.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.888 ' H ' HG23 ' A' ' 30' ' ' VAL . 33.1 mm-40 -92.03 -2.9 56.44 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.679 -0.859 . . . . 2.7400000000000002 108.679 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 . . . . . 0 N--CA 1.448 -0.543 0 CA-C-N 114.717 -1.129 . . . . 1.45 110.711 177.188 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.874 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.8 t . . . . . 0 CA--C 1.544 0.74 0 N-CA-C 110.371 -0.233 . . . . 1.1200000000000001 110.371 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.874 ' H ' HG23 ' A' ' 41' ' ' THR . 11.1 pt-20 -94.08 -30.44 14.66 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 123.011 1.386 . . . . 2.02 107.783 165.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.6 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.0 OUTLIER -60.86 -25.66 66.83 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 112.135 -2.302 . . . . 1.25 113.43 -171.245 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -53.08 -51.36 62.07 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 120.758 0.313 . . . . 1.9099999999999999 110.635 179.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.548 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -74.62 -35.6 62.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.07 0.462 . . . . 0.52000000000000002 110.212 178.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.704 ' HA ' ' CG1' ' A' ' 152' ' ' VAL . 95.1 t -58.91 -60.42 2.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.295 -0.866 . . . . 1.4099999999999999 111.372 179.074 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.579 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 11.6 ptpt -59.36 -35.57 74.15 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.258 -0.645 . . . . 0.67000000000000004 109.258 -178.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.713 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -66.63 -30.33 70.58 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.404 -0.817 . . . . 0.98999999999999999 110.654 -179.616 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.804 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -83.5 -38.46 21.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.243 0.544 . . . . 0.41999999999999998 110.463 176.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.513 HD12 ' CE2' ' A' ' 151' ' ' PHE . 0.8 OUTLIER -65.88 -27.31 68.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.382 -0.827 . . . . 1.3300000000000001 111.576 -176.368 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.713 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 6.4 ptp180 -81.41 -24.11 37.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.385 0.612 . . . . 2.1699999999999999 109.494 -178.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -75.49 -44.97 41.15 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.927 -1.033 . . . . 1.1000000000000001 109.271 174.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.78 -43.58 95.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.512 -0.767 . . . . 0.53000000000000003 109.885 173.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.645 ' O ' ' HG2' ' A' ' 58' ' ' GLU . . . -65.73 -32.82 84.21 Favored Glycine 0 C--O 1.221 -0.663 0 CA-C-N 115.356 -0.838 . . . . 0.69999999999999996 112.058 177.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -57.96 -48.02 81.22 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.842 -0.429 . . . . 1.04 109.842 178.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -66.42 -27.33 67.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.339 -0.846 . . . . 2.29 111.17 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.619 ' CE2' ' HA ' ' A' ' 102' ' ' ALA . 5.4 t80 -80.76 -27.86 36.64 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.32 -0.4 . . . . 2.29 111.47 -178.222 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.645 ' HG2' ' O ' ' A' ' 54' ' ' GLY . 36.9 mm-40 -49.82 -69.04 0.13 Allowed 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 112.216 0.451 . . . . 1.3 112.216 -178.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.809 ' H ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -53.98 -35.45 61.84 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.248 -0.887 . . . . 1.54 111.343 -179.443 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.711 ' N ' HD22 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -51.63 -62.07 1.85 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.607 -0.724 . . . . 2.5800000000000001 112.33 175.681 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.454 ' HD1' ' HB3' ' A' ' 65' ' ' PHE . 31.1 p90 -90.98 -11.41 39.01 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 112.022 0.378 . . . . 5.3200000000000003 112.022 -175.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.757 ' HG3' ' HE1' ' A' ' 65' ' ' PHE . 43.0 ttm180 -62.38 -29.72 70.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.674 0.273 . . . . 4.4800000000000004 111.277 -175.806 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -64.84 -35.14 80.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.345 -0.389 . . . . 4.7199999999999998 110.622 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.408 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -91.52 -50.4 5.8 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.396 0.517 . . . . 1.1699999999999999 112.396 -176.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.971 ' HA ' ' HB2' ' A' ' 68' ' ' LEU . 1.3 p90 -57.59 -27.32 62.61 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 112.581 0.586 . . . . 2.8100000000000001 112.581 -166.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.6 p -64.29 -33.35 75.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.01 0.433 . . . . 2.1899999999999999 110.539 177.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -90.28 -32.45 16.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.496 0.665 . . . . 2.7200000000000002 109.738 174.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.971 ' HB2' ' HA ' ' A' ' 65' ' ' PHE . 3.3 mp -60.1 -19.73 54.79 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-N 115.205 -0.907 . . . . 1.5600000000000001 112.506 -177.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.663 HG22 HG13 ' A' ' 74' ' ' ILE . 1.3 p -58.15 -28.43 64.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 118.29 0.496 . . . . 0.69999999999999996 111.114 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 21.8 t -71.53 -37.3 71.19 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 109.365 -0.606 . . . . 1.3400000000000001 109.365 173.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.45 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 13.2 mt-30 -68.44 -40.18 81.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.432 -0.804 . . . . 1.4199999999999999 110.088 178.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.443 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.0 mm? -68.72 -32.56 72.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.609 -0.269 . . . . 1.3700000000000001 110.64 172.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.5 m80 60.84 49.23 6.19 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.476 -0.935 . . . . 2.7200000000000002 108.476 -170.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.663 HG13 HG22 ' A' ' 69' ' ' THR . 33.1 mm -51.3 113.05 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 113.805 -1.543 . . . . 0.91000000000000003 112.325 -176.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.775 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -154.55 -172.93 0.34 Allowed Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 107.522 -1.288 . . . . 0.51000000000000001 107.522 -171.804 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.775 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.4 Cg_exo -29.91 166.28 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.332 0 C-N-CA 125.185 3.923 . . . . 0.46999999999999997 115.466 166.224 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.514 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.26 -31.2 0.01 OUTLIER Glycine 0 N--CA 1.472 1.048 0 N-CA-C 117.307 1.683 . . . . 0.40000000000000002 117.307 -173.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 76' ' ' PRO . 18.2 p -66.14 2.03 1.3 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 117.653 0.726 . . . . 0.56000000000000005 112.243 -179.065 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.25 -12.46 61.69 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.182 0.515 . . . . 0.34000000000000002 110.012 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.509 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 5.5 p90 -73.58 -21.76 60.25 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 109.212 -0.662 . . . . 4.1299999999999999 109.212 175.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.458 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 37.4 mt-30 -80.82 -25.58 37.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.867 0.841 . . . . 1.03 109.553 175.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.9 m -71.34 -51.67 22.96 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 114.482 -1.235 . . . . 0.47999999999999998 109.524 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.598 ' HE1' ' HB2' ' A' ' 106' ' ' PHE . 78.5 t80 -68.87 -18.65 64.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.057 -0.974 . . . . 1.1799999999999999 110.467 176.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.619 ' HA ' HG12 ' A' ' 87' ' ' VAL . 37.4 tt0 -59.51 -49.25 78.5 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.391 -0.822 . . . . 0.80000000000000004 110.339 176.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.403 ' HG3' ' H ' ' A' ' 85' ' ' GLN . 66.1 mt-30 -48.45 -32.6 7.99 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.805 -1.089 . . . . 1.6200000000000001 110.737 176.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.784 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -83.83 -53.07 11.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.803 -1.09 . . . . 1.3 110.815 -177.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.619 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.6 p -61.44 -23.92 32.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.492 0.663 . . . . 0.84999999999999998 109.602 -179.057 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.695 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.6 m-80 -68.47 -52.77 28.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.581 -1.191 . . . . 0.91000000000000003 111.102 174.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.937 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.8 OUTLIER -63.22 -36.54 83.98 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 121.881 0.848 . . . . 2.8700000000000001 108.762 -178.303 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.637 ' HG ' ' CD ' ' A' ' 89' ' ' GLU . 19.1 mt -68.89 -22.35 64.19 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 113.731 -1.577 . . . . 1.28 112.527 -167.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.73 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 5.6 p90 -106.79 -32.11 8.1 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 120.494 -0.483 . . . . 2.2999999999999998 111.842 -174.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.695 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.0 OUTLIER -81.54 -24.41 36.62 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.243 0.544 . . . . 5.0599999999999996 110.854 -172.689 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.474 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 0.4 OUTLIER -98.53 18.52 16.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.518 -0.764 . . . . 3.1200000000000001 112.713 -170.249 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 116.19 68.88 0.42 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 117.829 -2.129 . . . . 2.3100000000000001 114.756 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.73 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 63.5 t -70.49 105.39 1.42 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 CA-C-N 118.276 1.038 . . . . 1.0600000000000001 111.277 -176.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.467 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 3.5 p30 -110.12 -170.66 1.69 Allowed 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 113.675 -1.602 . . . . 2.1200000000000001 108.229 172.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.828 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 23.2 m-90 -62.86 -35.06 78.73 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.84 0.352 . . . . 3.3399999999999999 110.633 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.452 ' HA2' HG13 ' A' ' 101' ' ' VAL . . . -73.75 -38.47 50.05 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.996 -0.547 . . . . 0.68999999999999995 113.697 -176.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.467 ' HG2' ' ND2' ' A' ' 96' ' ' ASN . 16.1 mmt180 -54.19 -31.74 53.75 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.225 0.536 . . . . 4.2400000000000002 111.563 -178.515 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.429 HG12 ' HG ' ' A' ' 138' ' ' LEU . 78.9 mt -83.19 -34.16 10.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.954 -0.566 . . . . 0.44 111.653 -174.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.452 HG13 ' HA2' ' A' ' 98' ' ' GLY . 1.1 m -66.93 -25.97 35.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 109.344 -0.613 . . . . 1.3500000000000001 109.344 171.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.619 ' HA ' ' CE2' ' A' ' 57' ' ' PHE . . . -68.5 -51.87 38.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.194 0.521 . . . . 0.44 109.71 172.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -49.37 -54.56 16.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.5 -1.227 . . . . 1.49 111.936 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.507 ' HA ' ' CE ' ' A' ' 130' ' ' MET . 0.3 OUTLIER -73.49 -19.08 61.03 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 120.645 -0.422 . . . . 3.29 111.441 -172.844 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.667 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 67.9 m -77.31 -49.27 15.35 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.509 0.195 . . . . 1.1899999999999999 110.653 177.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.651 ' CZ ' HD12 ' B' 1008 ' ' LEU . 19.2 m-85 -60.51 -39.55 88.18 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 110.092 -0.336 . . . . 2.8900000000000001 110.092 177.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.893 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.99 -38.98 94.63 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.875 -0.678 . . . . 0.29999999999999999 111.959 177.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.992 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.6 -40.8 99.04 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.612 -0.804 . . . . 0.23000000000000001 111.362 175.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.13 -32.2 66.71 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.771 0.32 . . . . 0.31 110.76 177.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.544 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -58.31 -39.89 80.58 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 108.377 -0.972 . . . . 1.1200000000000001 108.377 179.48 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.75 ' SG ' HG22 ' A' ' 123' ' ' VAL . 40.1 t -51.25 -64.11 0.92 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 113.713 -1.585 . . . . 0.26000000000000001 110.247 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.835 ' HA ' HG13 ' A' ' 115' ' ' VAL . 44.6 t -61.57 -37.17 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-N 116.508 -0.314 . . . . 0.34999999999999998 111.826 -175.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.476 ' HG3' ' CG2' ' A' ' 69' ' ' THR . 4.0 mm-40 -60.21 -21.81 62.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.105 0.479 . . . . 2.5099999999999998 110.67 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.435 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 70.3 m -83.74 -42.77 16.19 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 108.061 -1.088 . . . . 0.28000000000000003 108.061 179.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.835 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.6 m -68.9 -28.79 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-N 114.796 -1.093 . . . . 1.23 109.515 -177.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -51.67 -51.03 59.1 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 113.26 -1.791 . . . . 0.59999999999999998 110.919 174.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 15.5 mmtp -84.7 13.92 5.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.523 -0.762 . . . . 1.6200000000000001 110.285 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 65.31 46.12 2.71 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.95 0.881 . . . . 1.8799999999999999 109.976 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.435 ' CE ' ' HA ' ' A' ' 114' ' ' SER . 26.8 mtm -126.7 38.24 4.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.559 -1.201 . . . . 0.31 107.889 -178.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.753 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 10.2 mp0 -54.68 -8.05 0.21 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 114.775 -1.102 . . . . 1.1499999999999999 113.048 -179.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.582 HG23 HD22 ' A' ' 122' ' ' LEU . 16.5 m -64.0 -27.56 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 O-C-N 121.831 -0.543 . . . . 0.46000000000000002 111.477 174.051 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.582 HD22 HG23 ' A' ' 121' ' ' VAL . 3.2 mm? -70.04 -25.48 63.58 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 110.235 -0.284 . . . . 0.26000000000000001 110.235 178.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.75 HG22 ' SG ' ' A' ' 111' ' ' CYS . 55.2 t -47.7 -51.38 7.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.587 -0.733 . . . . 0.25 111.819 -178.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.628 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 14.6 t -75.62 -31.48 59.89 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.881 0.372 . . . . 1.3500000000000001 110.598 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.499 ' NH1' ' HA3' ' A' ' 77' ' ' GLY . 58.6 mtp180 -66.42 -55.25 16.66 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 116.205 -0.452 . . . . 2.6699999999999999 110.418 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.544 HD13 ' HB3' ' A' ' 110' ' ' LEU . 87.7 mt -53.64 -42.82 52.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.591 -0.731 . . . . 0.23000000000000001 111.799 -175.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.651 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -60.27 -35.0 74.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.923 -0.311 . . . . 0.28999999999999998 110.89 178.371 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -64.15 -59.76 4.04 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.636 0.731 . . . . 0.28000000000000003 109.832 176.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.495 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 94.3 m95 -54.05 -46.15 71.86 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.251 -1.34 . . . . 3.9100000000000001 110.437 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.893 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 1.4 mmm -59.15 -59.41 5.51 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.784 -0.644 . . . . 1.0800000000000001 112.067 -177.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -59.81 -36.05 75.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 120.685 -0.406 . . . . 0.25 110.392 -177.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.429 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 23.3 m -64.49 -49.22 72.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.601 -0.272 . . . . 0.40000000000000002 111.571 176.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.486 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 14.1 m-85 -58.0 -36.37 72.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.766 0.317 . . . . 3.1299999999999999 110.351 178.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.733 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.5 tt -64.85 -51.06 64.09 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.986 -0.746 . . . . 0.94999999999999996 108.986 171.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . 0.429 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 4.5 m-80 -48.7 -49.59 37.2 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.07 0.548 . . . . 0.46000000000000002 112.034 178.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -80.15 -50.59 10.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.258 -0.428 . . . . 0.58999999999999997 111.897 -174.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . 0.486 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 22.2 m-70 -90.69 -51.69 5.25 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.067 0.765 . . . . 1.45 113.067 -170.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.733 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -82.71 -45.89 13.87 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.291 0.848 . . . . 1.2 113.291 -167.078 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.69 ' HA ' HD12 ' A' ' 142' ' ' ILE . 22.8 tt0 -42.08 -53.64 8.24 Favored Pre-proline 0 CA--C 1.542 0.652 0 O-C-N 124.123 0.89 . . . . 0.75 113.167 -172.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.49 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 19.3 Cg_endo -61.09 -47.6 12.12 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.889 1.726 . . . . 0.56000000000000005 111.998 178.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -55.37 -46.92 76.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.72 -0.673 . . . . 1.2 110.065 177.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.69 HD12 ' HA ' ' A' ' 139' ' ' GLU . 48.4 mt -49.08 -52.06 11.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.793 -0.64 . . . . 0.32000000000000001 111.798 175.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.8 mm-40 -59.9 -30.67 69.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.984 -0.553 . . . . 0.56999999999999995 111.434 -179.061 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.7 mm-40 -65.63 -20.81 66.46 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.705 0.764 . . . . 0.78000000000000003 110.594 176.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -111.29 10.92 21.67 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.002 -0.999 . . . . 0.93000000000000005 109.917 -175.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 114.39 -46.84 1.11 Allowed Glycine 0 N--CA 1.44 -1.044 0 CA-C-N 114.861 -1.063 . . . . 0.56000000000000005 112.813 173.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . 0.581 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 131.56 178.46 15.49 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.717 -0.754 . . . . 0.48999999999999999 111.9 -177.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.525 ' NE1' HD13 ' A' ' 142' ' ' ILE . 7.0 m-90 -68.54 -41.9 79.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.62 0.248 . . . . 3.5699999999999998 110.778 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.43 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 23.3 t70 -59.84 -37.75 80.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.32 0.581 . . . . 1.96 109.862 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.644 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 62.2 m -60.93 -37.53 82.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.306 -0.861 . . . . 0.67000000000000004 111.183 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.828 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 74.6 t80 -59.33 -40.53 86.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.059 0.457 . . . . 3.0 109.954 177.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.704 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -74.6 -24.89 18.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.475 0.655 . . . . 1.1499999999999999 110.094 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 31.8 mm-40 -66.38 -22.9 66.25 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.396 0.617 . . . . 1.6699999999999999 110.082 172.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.644 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.7 mt -93.82 -58.53 2.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.648 -0.705 . . . . 1.3 110.552 177.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -122.07 30.16 6.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.047 -0.524 . . . . 4.2400000000000002 111.594 -173.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.804 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -62.95 155.72 41.87 Favored Glycine 0 CA--C 1.502 -0.764 0 CA-C-O 121.654 0.585 . . . . 1.1000000000000001 113.682 -177.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.431 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 21.6 t-20 . . . . . 0 C--N 1.312 -1.059 0 CA-C-N 113.842 -1.179 . . . . 1.29 110.283 175.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . 0.79 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.53 1.008 0 CA-C-O 120.754 0.085 . . . . 1.2 112.954 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -89.23 -51.47 5.56 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.846 0.355 . . . . 2.8799999999999999 111.281 174.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -69.07 -62.83 1.22 Allowed 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 113.244 0.831 . . . . 1.3100000000000001 113.244 -167.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.651 HD12 ' CZ ' ' A' ' 106' ' ' PHE . 3.2 mm? -58.63 -53.23 60.72 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.149 -0.315 . . . . 1.3300000000000001 110.149 -176.307 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 0.937 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -38.0 -50.43 1.33 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.102 -0.954 . . . . 0.88 111.991 171.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -70.2 -47.88 59.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.084 -0.962 . . . . 1.03 111.706 -177.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -66.52 -27.42 67.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.007 0.432 . . . . 1.6699999999999999 111.247 -179.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.67 -11.14 80.54 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.939 -0.573 . . . . 0.78000000000000003 112.905 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 36.0 t70 -76.51 -5.32 47.04 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.17 0.509 . . . . 1.8999999999999999 110.647 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 10.0 m . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 116.09 -0.505 . . . . 1.4399999999999999 111.053 -177.721 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 120.69 0.281 . . . . 2.4199999999999999 110.812 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.1 t -86.67 -22.58 26.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.963 0.411 . . . . 1.25 110.731 -177.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.783 ' HA ' HD22 ' A' ' 8' ' ' LEU . 8.2 p30 -67.75 -22.66 65.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.106 0.479 . . . . 1.78 110.05 173.236 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.965 HH12 ' HA ' ' A' ' 128' ' ' ALA . 21.1 tpp180 -55.56 -49.6 72.26 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 115.263 -0.88 . . . . 1.3999999999999999 109.778 175.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -56.3 -52.28 65.09 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.475 -1.239 . . . . 0.68000000000000005 111.176 -177.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.783 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.8 OUTLIER -44.54 -43.73 8.21 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.269 -0.878 . . . . 1.1599999999999999 111.167 175.733 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.461 HG13 ' HE2' ' A' ' 130' ' ' MET . 76.1 t -72.17 -61.41 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.337 0.589 . . . . 0.27000000000000002 110.482 176.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 6' ' ' ARG . 68.2 t -52.91 -52.71 26.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.062 -0.972 . . . . 0.33000000000000002 113.036 -174.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -55.7 -34.52 65.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.066 0.46 . . . . 0.58999999999999997 110.549 -175.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.696 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 24.2 t80 -80.38 -43.01 21.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 116.102 -0.499 . . . . 1.6100000000000001 111.132 -178.052 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.834 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 3.9 mp -59.02 -41.63 88.24 Favored 'General case' 0 CA--C 1.522 -0.113 0 C-N-CA 120.066 -0.654 . . . . 0.34000000000000002 109.526 176.408 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -55.58 -43.21 75.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.641 -0.709 . . . . 1.05 110.604 176.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -71.45 -33.61 69.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.416 -0.811 . . . . 1.22 110.831 -177.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.711 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 9.9 mmpt? -76.54 -27.87 56.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.509 -0.314 . . . . 1.4099999999999999 111.593 -177.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.597 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -73.55 -29.51 62.49 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 120.103 -0.639 . . . . 1.3500000000000001 109.871 174.512 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.3 t -65.57 -28.83 69.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.79 -0.641 . . . . 0.93999999999999995 111.526 -176.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 28.5 pt20 -79.14 -5.88 55.21 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.433 0.635 . . . . 1.3700000000000001 110.86 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.488 ' HD2' ' HG3' ' A' ' 19' ' ' GLN . 18.6 mmmt -108.77 -25.17 10.95 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 122.148 0.975 . . . . 2.2000000000000002 108.946 -179.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.81 25.78 7.88 Favored Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 113.605 -1.634 . . . . 0.53000000000000003 111.227 179.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -120.33 166.74 13.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.315 -0.442 . . . . 0.76000000000000001 110.669 177.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.503 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 4.6 t -112.35 149.8 31.96 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.071 -0.513 . . . . 0.52000000000000002 110.327 178.25 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.423 ' CE2' HG13 ' A' ' 10' ' ' VAL . 2.8 t90 -67.63 -50.65 56.99 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.031 0.443 . . . . 3.3599999999999999 109.963 172.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.511 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 3.8 p -64.08 -31.65 72.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.559 -0.746 . . . . 1.3700000000000001 111.738 -171.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.503 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 95.0 mt-30 -56.4 -27.42 56.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.924 0.392 . . . . 1.1100000000000001 111.371 178.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -120.61 11.33 11.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.26 -0.427 . . . . 1.28 111.382 -175.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.604 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 59.0 p -98.02 -178.05 3.95 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.784 0.661 . . . . 1.8100000000000001 112.784 -170.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.53 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 11.1 t70 -170.66 -26.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 114.649 -1.16 . . . . 2.3100000000000001 109.441 -177.408 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.896 HG23 ' H ' ' A' ' 31' ' ' GLU . 6.6 m -47.43 -72.21 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-N 114.586 -1.188 . . . . 0.92000000000000004 112.866 -174.077 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.896 ' H ' HG23 ' A' ' 30' ' ' VAL . 7.9 pt-20 -102.48 1.17 34.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.483 0.659 . . . . 2.7400000000000002 109.386 175.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.53 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 15.5 tt0 . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 115.017 -0.992 . . . . 1.45 111.435 -179.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.862 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.8 t . . . . . 0 CA--C 1.538 0.497 0 N-CA-C 109.29 -0.633 . . . . 1.1200000000000001 109.29 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.862 ' H ' HG23 ' A' ' 41' ' ' THR . 13.7 pt-20 -93.28 -29.87 15.45 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 122.66 1.219 . . . . 2.02 108.418 164.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.716 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 6.7 p -60.42 -23.35 64.31 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 112.595 -2.093 . . . . 1.25 113.77 -170.241 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -55.91 -46.02 78.54 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.124 -0.63 . . . . 1.9099999999999999 109.9 179.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.511 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -76.57 -34.94 58.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.071 0.462 . . . . 0.52000000000000002 110.35 177.04 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.716 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 88.1 t -61.06 -61.08 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.514 -0.766 . . . . 1.4099999999999999 111.302 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.1 ptpt -59.91 -34.74 73.6 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.088 -0.708 . . . . 0.67000000000000004 109.088 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.636 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 5.4 mm100 -64.79 -41.49 95.8 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.729 -0.669 . . . . 0.98999999999999999 110.393 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.779 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -67.71 -36.38 80.51 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.336 0.589 . . . . 0.41999999999999998 110.392 175.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.2 mp -72.41 -24.14 61.19 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.411 -0.813 . . . . 1.3300000000000001 111.524 -178.255 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.636 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -81.31 -18.48 45.63 Favored 'General case' 0 CA--C 1.509 -0.613 0 C-N-CA 119.453 -0.899 . . . . 2.1699999999999999 109.027 178.0 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.477 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 4.3 mm-40 -80.46 -54.38 5.74 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.597 -1.183 . . . . 1.1000000000000001 109.983 175.302 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.83 -41.11 99.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.38 -0.827 . . . . 0.53000000000000003 109.907 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.685 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -64.04 -43.61 97.08 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.299 -0.864 . . . . 0.69999999999999996 111.413 175.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 51' ' ' ARG . 19.1 t70 -52.85 -50.11 64.42 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.432 0.293 . . . . 1.04 110.964 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.736 ' O ' ' HG2' ' A' ' 60' ' ' ARG . 41.4 mt-10 -65.32 -28.22 69.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.138 -0.483 . . . . 2.29 110.955 179.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.514 ' HE2' ' HB2' ' A' ' 102' ' ' ALA . 0.3 OUTLIER -81.09 -19.86 42.75 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.388 -0.369 . . . . 2.29 111.983 177.732 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.685 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 92.1 mt-10 -62.57 -57.07 12.44 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 122.516 -0.115 . . . . 1.3 111.15 -178.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.866 ' H ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -62.99 -31.96 73.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.727 -0.215 . . . . 1.54 111.255 179.191 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.736 ' HG2' ' O ' ' A' ' 56' ' ' GLU . 18.7 mmt180 -50.2 -52.03 39.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.231 -0.441 . . . . 2.5800000000000001 110.8 173.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.476 ' HB2' ' CZ ' ' A' ' 65' ' ' PHE . 28.9 m-85 -92.47 -3.83 54.57 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.206 -0.452 . . . . 5.3200000000000003 111.827 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.797 ' HB2' ' HA ' ' A' ' 59' ' ' LEU . 21.7 tpp180 -50.43 -50.81 51.04 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.577 0.584 . . . . 4.4800000000000004 112.577 -171.058 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -71.41 -16.29 62.39 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.191 0.519 . . . . 4.7199999999999998 111.084 -177.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.499 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -90.2 -38.98 13.09 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.498 0.555 . . . . 1.1699999999999999 112.498 -172.436 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.476 ' CZ ' ' HB2' ' A' ' 61' ' ' TYR . 44.8 m-85 -45.56 -46.46 14.16 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.247 0.832 . . . . 2.8100000000000001 113.247 -170.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.9 t -66.27 -27.14 67.71 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.086 0.47 . . . . 2.1899999999999999 111.215 -174.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -88.56 -34.49 17.34 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.497 0.665 . . . . 2.7200000000000002 109.502 176.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.709 ' O ' HD12 ' A' ' 72' ' ' LEU . 5.5 mp -66.45 -31.37 72.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.139 -0.937 . . . . 1.5600000000000001 112.595 -176.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.71 HG22 HG13 ' A' ' 74' ' ' ILE . 11.7 p -61.17 -24.23 66.16 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.109 -0.636 . . . . 0.69999999999999996 110.661 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.1 t -77.65 -41.02 39.75 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.824 -0.625 . . . . 1.3400000000000001 109.391 172.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.609 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 12.9 mt-30 -61.03 -49.48 77.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.369 -0.832 . . . . 1.4199999999999999 110.588 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.73 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.2 mp -75.53 -31.33 60.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.63 -0.713 . . . . 1.3700000000000001 110.603 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 48.0 m80 65.92 59.69 0.7 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.64 0.733 . . . . 2.7200000000000002 109.131 -172.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.71 HG13 HG22 ' A' ' 69' ' ' THR . 23.6 mm -59.29 112.79 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.4 -1.273 . . . . 0.91000000000000003 111.382 -178.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.741 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -153.07 -171.97 0.3 Allowed Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 107.781 -1.192 . . . . 0.51000000000000001 107.781 -170.029 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.741 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 21.7 Cg_exo -30.25 166.2 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 124.911 3.74 . . . . 0.46999999999999997 114.935 165.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.498 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -29.59 -30.23 0.01 OUTLIER Glycine 0 N--CA 1.472 1.058 0 N-CA-C 117.282 1.673 . . . . 0.40000000000000002 117.282 -172.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.457 ' N ' ' O ' ' A' ' 76' ' ' PRO . 32.2 p -67.87 6.12 0.75 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 118.019 0.909 . . . . 0.56000000000000005 112.157 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.57 -12.92 61.87 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.962 0.411 . . . . 0.34000000000000002 109.982 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.498 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 5.0 p90 -78.26 -16.34 57.89 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.15 0.5 . . . . 4.1299999999999999 109.68 175.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.534 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 32.3 mt-30 -84.78 -24.51 28.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.775 0.798 . . . . 1.03 109.604 171.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.73 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 13.0 m -73.46 -52.1 14.84 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 114.566 -1.197 . . . . 0.47999999999999998 109.361 172.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.564 ' HA ' HG23 ' A' ' 86' ' ' VAL . 86.9 t80 -67.14 -17.02 64.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.183 -0.917 . . . . 1.1799999999999999 109.908 175.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.635 ' HA ' HG12 ' A' ' 87' ' ' VAL . 43.0 tt0 -58.54 -48.86 79.47 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.033 -0.531 . . . . 0.80000000000000004 110.195 174.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -47.14 -35.45 7.24 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.176 -0.92 . . . . 1.6200000000000001 110.917 174.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.76 HG13 ' HG ' ' B' 1008 ' ' LEU . 1.7 t -82.14 -49.91 16.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 114.534 -1.212 . . . . 1.3 110.503 -175.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.635 HG12 ' HA ' ' A' ' 84' ' ' GLU . 8.4 p -62.8 -21.35 27.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 O-C-N 121.494 -0.754 . . . . 0.84999999999999998 109.991 179.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.489 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 3.0 m-80 -78.44 -37.34 43.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.373 -1.285 . . . . 0.91000000000000003 112.475 177.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 1.104 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.3 pp20? -73.38 -29.27 62.52 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 108.904 -0.776 . . . . 2.8700000000000001 108.904 175.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.759 ' HB3' ' NH1' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -72.72 -35.82 67.65 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-N 114.549 -1.205 . . . . 1.28 111.401 -168.087 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.489 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -103.87 12.91 33.85 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.136 0.493 . . . . 2.2999999999999998 110.918 -173.168 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.903 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -51.91 -43.12 63.26 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.404 -0.816 . . . . 5.0599999999999996 112.09 -178.318 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.916 ' HB3' HD21 ' A' ' 96' ' ' ASN . 14.7 t70 -74.0 -23.12 59.39 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 122.066 0.936 . . . . 3.1200000000000001 110.371 177.113 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.853 ' O ' HG23 ' A' ' 95' ' ' VAL . . . 131.03 -38.7 1.89 Allowed Glycine 0 N--CA 1.436 -1.307 0 CA-C-N 114.037 -1.438 . . . . 2.3100000000000001 110.245 177.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.853 HG23 ' O ' ' A' ' 94' ' ' GLY . 2.7 t 172.88 135.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.347 0.488 0 C-N-CA 126.96 2.104 . . . . 1.0600000000000001 108.388 160.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.916 HD21 ' HB3' ' A' ' 93' ' ' ASP . 2.9 m120 -111.35 147.14 35.79 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.431 -0.581 . . . . 2.1200000000000001 109.431 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.563 ' HA ' ' CE3' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -54.51 -46.49 73.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.188 0.518 . . . . 3.3399999999999999 110.581 177.437 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.445 ' HA2' HG13 ' A' ' 101' ' ' VAL . . . -79.32 -19.57 71.49 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.925 -0.655 . . . . 0.68999999999999995 112.872 -178.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.831 ' HG2' ' H ' ' A' ' 96' ' ' ASN . 0.1 OUTLIER -72.45 -28.74 63.13 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.73 -0.47 . . . . 4.2400000000000002 109.73 -179.354 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 77.5 mt -65.27 -38.52 82.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.76 -0.459 . . . . 0.44 109.76 177.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.464 ' HA ' ' CD1' ' A' ' 104' ' ' PHE . 2.0 m -69.66 -34.69 62.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 116.134 -0.484 . . . . 1.3500000000000001 109.93 175.218 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.514 ' HB2' ' HE2' ' A' ' 57' ' ' PHE . . . -63.23 -49.34 74.52 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.558 0.694 . . . . 0.44 110.078 175.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -55.13 -49.11 72.59 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.313 -1.312 . . . . 1.49 111.715 -179.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.587 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 0.2 OUTLIER -77.27 -26.59 52.57 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.489 -0.484 . . . . 3.29 110.832 -176.336 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.696 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 29.2 t -73.55 -49.42 26.53 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.109 0.48 . . . . 1.1899999999999999 110.197 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.495 ' HZ ' HD11 ' A' ' 72' ' ' LEU . 29.2 t80 -71.2 -24.89 62.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.893 -0.594 . . . . 2.8900000000000001 109.802 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.403 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -68.19 -43.25 81.1 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.804 -0.712 . . . . 0.29999999999999999 111.334 172.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.834 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.61 -32.41 84.08 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.77 -0.729 . . . . 0.23000000000000001 111.319 174.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.58 -30.02 61.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.827 0.346 . . . . 0.31 110.639 175.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.548 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.8 -41.18 97.96 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 107.988 -1.116 . . . . 1.1200000000000001 107.988 -179.634 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.691 ' SG ' HG22 ' A' ' 123' ' ' VAL . 25.0 t -52.58 -54.55 31.47 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.468 -1.696 . . . . 0.26000000000000001 110.904 173.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.405 HG11 ' HD3' ' A' ' 20' ' ' LYS . 68.9 t -64.37 -41.25 91.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 0.34999999999999998 111.588 -177.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.51 ' HB3' HG21 ' A' ' 74' ' ' ILE . 1.4 mm-40 -60.62 -25.03 65.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.035 0.445 . . . . 2.5099999999999998 110.746 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.454 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 50.6 m -77.14 -40.59 45.05 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 108.896 -0.779 . . . . 0.28000000000000003 108.896 174.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 111' ' ' CYS . 98.2 t -64.47 -35.42 74.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.095 -0.957 . . . . 1.23 109.461 -179.613 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -50.17 -50.89 47.67 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 113.582 -1.645 . . . . 0.59999999999999998 111.129 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.406 ' HB2' ' HG3' ' A' ' 119' ' ' MET . 12.8 mmtp -87.2 14.1 8.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.703 -0.68 . . . . 1.6200000000000001 110.621 -179.188 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.419 ' HA ' HE21 ' A' ' 120' ' ' GLN . 39.8 mt-10 66.1 38.34 4.8 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.443 0.639 . . . . 1.8799999999999999 110.308 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.465 ' HB3' HD23 ' A' ' 122' ' ' LEU . 24.7 mtm -117.71 50.16 1.16 Allowed 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.551 -0.907 . . . . 0.31 108.551 -178.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.419 HE21 ' HA ' ' A' ' 118' ' ' GLU . 3.6 mt-30 -65.63 -7.1 13.35 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.725 -1.125 . . . . 1.1499999999999999 112.285 -176.116 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.531 HG23 HD22 ' A' ' 122' ' ' LEU . 30.0 m -68.04 -20.54 25.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.616 0.246 . . . . 0.46000000000000002 111.349 173.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.724 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -76.39 -27.18 56.25 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 110.216 -0.29 . . . . 0.26000000000000001 110.216 177.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.691 HG22 ' SG ' ' A' ' 111' ' ' CYS . 56.3 t -44.69 -53.15 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 O-C-N 123.986 0.804 . . . . 0.25 112.162 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.604 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 1.5 p -69.93 -39.42 76.14 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-O 120.86 0.362 . . . . 1.3500000000000001 111.587 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.724 ' HD2' HD13 ' A' ' 122' ' ' LEU . 92.2 mtt180 -62.15 -55.5 28.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.571 -0.74 . . . . 2.6699999999999999 110.183 -177.252 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.622 ' HA ' ' CE2' ' A' ' 129' ' ' TRP . 77.9 mt -51.93 -51.14 30.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.512 -0.767 . . . . 0.23000000000000001 111.177 -179.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.66 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.81 -25.57 63.29 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.804 0.298 . . . . 0.28999999999999998 111.804 -178.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.965 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -67.35 -63.88 0.97 Allowed 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.131 0.491 . . . . 0.28000000000000003 110.089 -178.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . 0.622 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 24.1 p-90 -78.1 -16.72 57.74 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 115.304 -0.862 . . . . 3.9100000000000001 112.059 -174.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.607 ' SD ' HG22 ' A' ' 126' ' ' ILE . 81.7 mtp -59.39 -54.35 47.77 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.144 -0.622 . . . . 1.0800000000000001 109.822 169.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.47 -38.29 77.67 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.763 -0.653 . . . . 0.25 110.689 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.606 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 56.7 m -60.92 -43.34 98.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 121.062 -0.255 . . . . 0.40000000000000002 111.378 175.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.477 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 82.7 t80 -59.71 -43.09 94.28 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.963 -0.384 . . . . 3.1299999999999999 109.963 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.717 HD13 ' HB2' ' A' ' 5' ' ' ASN . 5.4 tt -60.62 -47.62 85.42 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.734 -0.839 . . . . 0.94999999999999996 108.734 174.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . 0.425 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 2.8 m-80 -48.37 -58.59 4.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.663 -0.699 . . . . 0.46000000000000002 112.394 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -81.39 -45.56 15.92 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.197 0.443 . . . . 0.58999999999999997 112.197 -173.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . 0.477 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 1.6 m-70 -90.64 -50.14 6.09 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.744 0.646 . . . . 1.45 112.744 -170.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.62 HD21 ' NH2' ' A' ' 99' ' ' ARG . 59.9 mt -89.33 -39.03 13.72 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 113.44 0.904 . . . . 1.2 113.44 -165.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.648 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 32.1 tt0 -50.81 -52.45 57.01 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-O 119.134 -0.46 . . . . 0.75 112.098 -172.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.637 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.1 Cg_exo -53.85 -51.71 10.11 Favored 'Trans proline' 0 C--N 1.358 1.049 0 C-N-CA 121.772 1.648 . . . . 0.56000000000000005 111.505 176.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . 0.505 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 8.4 t-105 -55.14 -51.9 64.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.186 -0.915 . . . . 1.2 110.678 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.602 HD12 ' HA ' ' A' ' 139' ' ' GLU . 59.7 mt -46.85 -53.06 3.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.884 -0.598 . . . . 0.32000000000000001 111.654 172.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.648 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 76.3 mm-40 -62.18 -29.87 70.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.085 -0.507 . . . . 0.56999999999999995 111.675 -178.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.637 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 11.6 mm-40 -63.95 -20.57 65.97 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.611 0.72 . . . . 0.78000000000000003 110.437 175.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.665 ' N ' HD22 ' A' ' 145' ' ' ASN . 0.7 OUTLIER -104.1 0.94 30.28 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.072 -0.967 . . . . 0.93000000000000005 109.019 -175.487 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 124.8 -46.24 1.1 Allowed Glycine 0 N--CA 1.441 -1.028 0 CA-C-N 114.85 -1.068 . . . . 0.56000000000000005 112.299 178.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . 0.429 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 135.03 178.21 15.51 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.238 -0.745 . . . . 0.48999999999999999 111.238 -177.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.688 ' HB2' ' OE1' ' A' ' 42' ' ' GLU . 5.2 m-90 -63.5 -37.66 88.17 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 117.056 0.428 . . . . 3.5699999999999998 110.412 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 20.7 m-20 -52.85 -43.9 66.39 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.211 0.529 . . . . 1.96 110.203 176.243 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.574 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 89.2 m -60.24 -37.82 81.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.211 -0.904 . . . . 0.67000000000000004 111.95 -175.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.438 ' CE2' HD12 ' A' ' 50' ' ' LEU . 84.7 t80 -62.97 -38.46 91.19 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.402 -0.519 . . . . 3.0 109.989 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.643 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.5 m -74.67 -24.57 18.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.222 0.534 . . . . 1.1499999999999999 109.774 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 36.2 mm-40 -64.35 -25.49 68.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.201 0.524 . . . . 1.6699999999999999 110.081 173.042 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.0 mt -96.03 -57.42 2.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.697 -0.683 . . . . 1.3 110.476 178.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -120.36 28.82 7.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.561 -0.745 . . . . 4.2400000000000002 111.279 -170.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.779 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -60.94 167.69 10.84 Favored Glycine 0 CA--C 1.501 -0.817 0 CA-C-N 115.576 -0.738 . . . . 1.1000000000000001 113.258 179.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.557 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 28.8 t-20 . . . . . 0 C--N 1.31 -1.145 0 CA-C-N 113.994 -1.103 . . . . 1.29 111.49 -178.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . 0.943 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.529 0.918 0 N-CA-C 113.416 0.126 . . . . 1.2 113.416 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.4 mpt_? -83.3 -56.86 3.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.003 0.43 . . . . 2.8799999999999999 111.133 174.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -67.83 -54.98 14.74 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.895 0.702 . . . . 1.3100000000000001 112.895 -169.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.76 ' HG ' HG13 ' A' ' 86' ' ' VAL . 3.0 mm? -58.44 -53.64 56.01 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.227 0.329 . . . . 1.3300000000000001 110.965 -175.378 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 1.104 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -47.65 -45.74 28.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.701 0.762 . . . . 0.88 110.848 176.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -67.12 -54.45 21.23 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.303 -1.317 . . . . 1.03 111.406 -177.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -66.71 -17.1 64.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.516 . . . . 1.6699999999999999 110.528 179.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -83.94 -3.99 88.85 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.863 -0.608 . . . . 0.78000000000000003 113.467 -176.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -93.56 3.9 54.8 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.645 0.736 . . . . 1.8999999999999999 109.796 176.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 34.4 m . . . . . 0 C--N 1.327 -0.381 0 CA-C-N 115.668 -0.696 . . . . 1.4399999999999999 111.687 -175.263 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 . . . . . 0 C--O 1.233 0.188 0 CA-C-O 121.682 0.753 . . . . 2.4199999999999999 109.546 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.446 ' CB ' ' HG2' ' A' ' 42' ' ' GLU . 0.9 OUTLIER -72.78 -3.97 28.65 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.097 -0.956 . . . . 1.25 110.852 -178.427 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.554 ' HB2' ' HG ' ' A' ' 134' ' ' LEU . 3.3 p30 -62.97 -26.66 68.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.986 -0.552 . . . . 1.78 111.218 177.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.829 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.9 tpp180 -51.52 -49.87 61.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.05 -0.523 . . . . 1.3999999999999999 110.506 173.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.813 ' HB3' ' HE3' ' A' ' 47' ' ' LYS . 53.1 mt-10 -50.49 -52.74 35.56 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.964 -1.017 . . . . 0.68000000000000005 112.066 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.65 HD11 HG22 ' A' ' 46' ' ' VAL . 1.2 mp -50.71 -31.47 16.59 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.913 0.885 . . . . 1.1599999999999999 112.094 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.482 HG13 ' HE2' ' A' ' 130' ' ' MET . 96.3 t -80.35 -60.35 2.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-O 121.48 0.657 . . . . 0.27000000000000002 110.023 174.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 6' ' ' ARG . 46.4 t -53.37 -54.2 19.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 114.79 -1.095 . . . . 0.33000000000000002 112.755 -174.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -57.25 -36.53 71.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.128 0.489 . . . . 0.58999999999999997 110.316 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.704 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -66.31 -53.54 35.33 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.633 -0.712 . . . . 1.6100000000000001 109.985 179.246 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 1.015 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.7 mp -60.68 -38.5 85.15 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 120.699 0.285 . . . . 0.34000000000000002 110.827 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.515 ' HA ' ' CB ' ' A' ' 24' ' ' TRP . 27.0 t -60.67 -37.05 80.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.17 0.51 . . . . 1.05 110.677 177.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -77.07 -23.81 51.92 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.975 -0.557 . . . . 1.22 110.252 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.795 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 8.8 mmpt? -81.67 -39.94 23.6 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.281 -0.418 . . . . 1.4099999999999999 111.648 -177.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.593 HD23 ' HA ' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -61.99 -27.84 69.15 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 119.926 -0.709 . . . . 1.3500000000000001 110.183 176.294 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.7 t -75.04 -13.9 60.54 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.526 -0.761 . . . . 0.93999999999999995 111.337 -177.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.795 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 20.7 pt20 -81.01 -9.39 59.85 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.388 0.613 . . . . 1.3700000000000001 111.883 -177.28 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.802 ' HZ3' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -120.02 -20.3 7.52 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 122.048 0.928 . . . . 2.2000000000000002 109.646 178.828 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.65 29.98 5.4 Favored Glycine 0 C--N 1.305 -1.18 0 CA-C-N 113.869 -1.514 . . . . 0.53000000000000003 112.799 175.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -109.82 169.69 8.55 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.715 0.293 . . . . 0.76000000000000001 110.909 168.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.5 t -105.27 150.19 25.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.153 0.501 . . . . 0.52000000000000002 110.843 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.593 ' HA ' HD23 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -81.11 -43.79 18.91 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.346 -0.843 . . . . 3.3599999999999999 110.032 172.88 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.452 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 7.0 p -71.21 -23.51 62.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.971 -0.559 . . . . 1.3700000000000001 111.564 -172.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -65.15 -27.26 68.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.902 0.382 . . . . 1.1100000000000001 110.966 175.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -122.28 16.56 10.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.05 -0.523 . . . . 1.28 112.21 -174.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.452 ' OG ' ' HA ' ' A' ' 25' ' ' SER . 90.2 p -100.61 -179.23 4.03 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.88 0.696 . . . . 1.8100000000000001 112.88 -172.822 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.544 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.9 t70 -168.59 -24.19 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.324 -1.307 . . . . 2.3100000000000001 109.806 178.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.832 HG23 ' H ' ' A' ' 31' ' ' GLU . 9.2 m -47.48 -70.95 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 114.912 -1.04 . . . . 0.92000000000000004 113.08 -171.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.832 ' H ' HG23 ' A' ' 30' ' ' VAL . 9.3 pt-20 -100.82 2.43 41.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.721 0.772 . . . . 2.7400000000000002 109.054 175.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.544 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 29.5 tt0 . . . . . 0 N--CA 1.448 -0.534 0 CA-C-N 114.624 -1.171 . . . . 1.45 111.127 -177.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.802 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.5 t . . . . . 0 CA--C 1.54 0.575 0 N-CA-C 111.482 0.178 . . . . 1.1200000000000001 111.482 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.802 ' H ' HG23 ' A' ' 41' ' ' THR . 11.9 pt-20 -94.56 -30.58 14.3 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-O 122.152 0.977 . . . . 2.02 110.376 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.932 ' HA ' HG13 ' A' ' 46' ' ' VAL . 58.5 m -75.66 -17.85 59.84 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.725 -1.58 . . . . 1.25 114.372 -166.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.583 ' HA ' ' CD ' ' A' ' 47' ' ' LYS . 39.4 tt0 -45.68 -47.02 15.09 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 118.237 0.471 . . . . 1.9099999999999999 111.113 -177.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.64 -46.03 64.06 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.721 0.267 . . . . 0.52000000000000002 111.721 175.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.932 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.9 m -67.1 -35.47 74.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 120.946 0.403 . . . . 1.4099999999999999 111.309 -175.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.813 ' HE3' ' HB3' ' A' ' 7' ' ' GLU . 6.8 ptmt -77.66 -32.29 53.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.963 -0.754 . . . . 0.67000000000000004 108.963 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.735 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -66.08 -30.47 70.99 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.719 -0.673 . . . . 0.98999999999999999 110.131 173.512 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.641 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -76.95 -42.66 38.3 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.233 0.54 . . . . 0.41999999999999998 111.077 176.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.561 HD21 ' HD2' ' A' ' 104' ' ' PHE . 1.3 tp -66.29 -25.1 66.7 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.621 -0.718 . . . . 1.3300000000000001 112.486 -173.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.735 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.9 ptp180 -81.33 -28.42 34.55 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 109.069 -0.715 . . . . 2.1699999999999999 109.069 -175.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 10.8 mm-40 -74.2 -49.17 24.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.546 -1.206 . . . . 1.1000000000000001 109.38 176.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.65 -39.35 88.01 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.483 -0.78 . . . . 0.53000000000000003 110.092 174.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.67 ' HA3' ' HZ ' ' A' ' 12' ' ' PHE . . . -63.91 -43.88 96.87 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.59 -0.732 . . . . 0.69999999999999996 112.047 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.615 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 32.6 t70 -58.14 -43.74 87.47 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.691 0.281 . . . . 1.04 110.256 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 52' ' ' GLU . 78.0 mm-40 -58.19 -28.3 64.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.687 -0.688 . . . . 2.29 111.381 177.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -81.69 -44.54 16.98 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.919 -0.582 . . . . 2.29 110.83 176.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.654 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 37.4 mt-10 -61.96 -63.2 1.33 Allowed 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.833 -0.621 . . . . 1.3 112.007 -172.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.713 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -48.9 -34.25 12.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.999 0.74 . . . . 1.54 112.999 -173.738 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.713 ' H ' HD12 ' A' ' 59' ' ' LEU . 71.5 mtt-85 -62.88 -61.6 2.29 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.109 0.481 . . . . 2.5800000000000001 111.45 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -92.05 -3.61 55.55 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.827 -0.624 . . . . 5.3200000000000003 112.073 -173.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -49.93 -29.58 8.62 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 113.047 0.758 . . . . 4.4800000000000004 113.047 -175.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.9 mtp180 -54.32 -34.08 60.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.799 0.333 . . . . 4.7199999999999998 111.741 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.641 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -88.72 -26.6 21.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.491 -0.322 . . . . 1.1699999999999999 111.418 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.605 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 39.0 t80 -46.83 -45.99 20.52 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.557 0.577 . . . . 2.8100000000000001 112.557 -173.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.4 p -69.0 -24.92 64.28 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.848 0.356 . . . . 2.1899999999999999 111.629 -175.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -90.57 -29.77 17.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.482 -0.326 . . . . 2.7200000000000002 111.182 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.665 ' O ' HD12 ' A' ' 72' ' ' LEU . 18.8 mt -61.55 -22.77 65.46 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 112.589 0.589 . . . . 1.5600000000000001 112.589 -173.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.624 HG22 HG13 ' A' ' 74' ' ' ILE . 15.8 p -58.68 -23.31 59.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 0.69999999999999996 110.956 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 7.6 t -77.66 -38.99 46.49 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.903 -0.59 . . . . 1.3400000000000001 109.64 176.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.52 ' NE2' HD22 ' A' ' 68' ' ' LEU . 12.4 mt-30 -65.15 -54.45 29.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.691 -0.686 . . . . 1.4199999999999999 109.837 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.665 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.2 mp -66.36 -30.48 70.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.452 -0.794 . . . . 1.3700000000000001 110.129 179.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 63.71 59.83 1.13 Allowed 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 122.167 0.984 . . . . 2.7200000000000002 108.474 -175.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.624 HG13 HG22 ' A' ' 69' ' ' THR . 17.2 mm -57.82 122.96 8.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 113.789 -1.55 . . . . 0.91000000000000003 111.01 -178.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.749 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -157.34 -172.82 0.34 Allowed Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 108.021 -1.104 . . . . 0.51000000000000001 108.021 -168.825 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.749 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 34.9 Cg_exo -29.63 165.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 125.119 3.879 . . . . 0.46999999999999997 115.266 165.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.435 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.56 -29.9 0.01 OUTLIER Glycine 0 N--CA 1.473 1.151 0 N-CA-C 117.33 1.692 . . . . 0.40000000000000002 117.33 -174.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 76' ' ' PRO . 39.4 p -71.66 11.08 0.54 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 117.79 0.795 . . . . 0.56000000000000005 111.938 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.01 -13.17 61.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.246 0.546 . . . . 0.34000000000000002 109.736 172.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -78.79 -14.57 59.19 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.173 -0.677 . . . . 4.1299999999999999 109.173 175.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.433 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 53.5 mt-30 -84.52 -20.87 30.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.828 0.823 . . . . 1.03 109.917 172.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.595 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 6.5 m -80.02 -48.64 12.99 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 114.575 -1.193 . . . . 0.47999999999999998 108.828 169.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -62.75 -17.43 60.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.887 -1.051 . . . . 1.1799999999999999 109.915 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.645 ' HA ' HG12 ' A' ' 87' ' ' VAL . 34.7 tt0 -60.49 -50.44 73.53 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.458 -0.792 . . . . 0.80000000000000004 110.579 177.437 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -47.47 -35.14 8.22 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.01 -0.995 . . . . 1.6200000000000001 110.702 176.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.643 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.6 t -81.83 -51.38 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.978 0 CA-C-N 114.485 -1.234 . . . . 1.3 110.7 -177.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.645 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.8 p -61.58 -23.9 32.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-O 121.554 0.692 . . . . 0.84999999999999998 109.731 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.427 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 1.8 m-80 -71.99 -40.74 68.34 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.402 -1.272 . . . . 0.91000000000000003 111.977 176.433 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 1.03 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.3 pp20? -73.23 -29.43 62.78 Favored 'General case' 0 CA--C 1.495 -1.149 0 CA-C-O 121.699 0.761 . . . . 2.8700000000000001 109.127 177.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.691 ' HG ' ' HD3' ' A' ' 99' ' ' ARG . 0.1 OUTLIER -71.05 -32.52 69.27 Favored 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.556 -1.202 . . . . 1.28 111.619 -168.158 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.427 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 2.3 p90 -107.47 11.69 28.59 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.108 0.48 . . . . 2.2999999999999998 110.859 -172.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.911 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -54.42 -34.53 61.53 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.685 -0.689 . . . . 5.0599999999999996 112.553 -177.789 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.998 ' HB3' HD21 ' A' ' 96' ' ' ASN . 15.4 t70 -84.48 -18.76 34.8 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 122.101 0.953 . . . . 3.1200000000000001 110.239 176.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.866 ' O ' HG23 ' A' ' 95' ' ' VAL . . . 130.95 -40.0 1.71 Allowed Glycine 0 N--CA 1.44 -1.037 0 CA-C-N 114.234 -1.348 . . . . 2.3100000000000001 110.918 173.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.866 HG23 ' O ' ' A' ' 94' ' ' GLY . 2.9 t 173.36 110.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.349 0.566 0 C-N-CA 127.022 2.129 . . . . 1.0600000000000001 108.15 160.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.998 HD21 ' HB3' ' A' ' 93' ' ' ASP . 1.1 m120 -83.91 152.83 24.3 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.753 -0.462 . . . . 2.1200000000000001 109.753 -177.023 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.54 ' HH2' ' HB2' ' A' ' 155' ' ' TYR . 84.9 t90 -59.04 -52.84 64.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.272 0.558 . . . . 3.3399999999999999 110.111 178.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.436 ' HA2' HG13 ' A' ' 101' ' ' VAL . . . -77.41 -16.34 80.5 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.646 -0.706 . . . . 0.68999999999999995 112.698 -177.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.805 ' HB3' ' HB2' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -72.51 -29.26 63.45 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.535 -0.542 . . . . 4.2400000000000002 109.535 -179.635 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 33.0 mt -63.3 -45.11 99.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 109.394 -0.595 . . . . 0.44 109.394 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.436 HG13 ' HA2' ' A' ' 98' ' ' GLY . 1.8 m -62.6 -39.33 84.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.827 -0.624 . . . . 1.3500000000000001 109.648 175.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.24 -44.86 94.02 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 121.087 0.47 . . . . 0.44 111.04 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -58.66 -42.06 87.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.289 -0.869 . . . . 1.49 110.956 -179.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.651 ' HZ ' ' HB2' ' A' ' 134' ' ' LEU . 28.9 m-85 -80.63 -30.18 36.71 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.671 0.272 . . . . 3.29 111.145 179.229 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.59 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 48.0 t -63.65 -56.23 17.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.153 -0.476 . . . . 1.1899999999999999 110.222 176.003 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.448 ' HA ' ' HB3' ' A' ' 109' ' ' ALA . 32.7 t80 -74.31 -26.34 60.11 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.928 -0.578 . . . . 2.8900000000000001 110.364 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.99 -45.59 86.68 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.336 -0.935 . . . . 0.29999999999999999 111.016 173.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 1.015 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.5 -29.42 74.78 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 111.11 -0.796 . . . . 0.23000000000000001 111.11 174.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.605 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -71.51 -34.54 70.19 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.983 -0.377 . . . . 0.31 109.983 176.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.486 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.3 OUTLIER -67.55 -34.88 77.97 Favored 'General case' 0 CA--C 1.506 -0.741 0 CA-C-O 121.892 0.853 . . . . 1.1200000000000001 109.781 -179.267 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.698 ' SG ' HG13 ' A' ' 123' ' ' VAL . 44.2 t -51.25 -50.73 58.65 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.295 -1.321 . . . . 0.26000000000000001 109.271 170.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.802 HG13 ' HZ3' ' A' ' 20' ' ' LYS . 86.3 t -63.84 -38.19 81.69 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 CA-C-N 116.252 -0.431 . . . . 0.34999999999999998 110.514 175.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.489 ' HB3' HG13 ' A' ' 74' ' ' ILE . 42.8 mt-10 -56.12 -33.19 64.91 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.977 0.418 . . . . 2.5099999999999998 110.552 176.168 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.461 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 25.1 m -79.73 -41.65 26.24 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.006 -0.543 . . . . 0.28000000000000003 109.557 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 111' ' ' CYS . 99.3 t -68.74 -31.01 49.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.827 0.822 . . . . 1.23 109.739 -175.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -55.61 -47.9 75.8 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.015 -1.448 . . . . 0.59999999999999998 110.858 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 23.8 mmtt -90.2 14.42 12.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.678 -0.692 . . . . 1.6200000000000001 110.325 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 62.25 43.78 8.16 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.74 0.781 . . . . 1.8799999999999999 111.278 -179.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.465 ' HB3' HD23 ' A' ' 122' ' ' LEU . 32.8 mtm -115.96 49.33 1.12 Allowed 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.645 -1.242 . . . . 0.31 107.645 178.616 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.432 ' CD ' ' H ' ' A' ' 120' ' ' GLN . 6.4 mp0 -67.85 -6.72 22.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.182 -1.372 . . . . 1.1499999999999999 112.455 -171.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.469 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 27.0 m -72.52 -12.79 16.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.935 0.398 . . . . 0.46000000000000002 111.211 175.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.71 HD13 ' HD3' ' A' ' 125' ' ' ARG . 2.9 mm? -83.62 -24.09 31.58 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 109.776 -0.453 . . . . 0.26000000000000001 109.776 176.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.698 HG13 ' SG ' ' A' ' 111' ' ' CYS . 67.4 t -46.9 -55.58 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.783 -0.644 . . . . 0.25 112.223 -178.31 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 12.8 t -73.88 -31.41 63.13 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.729 -0.388 . . . . 1.3500000000000001 110.142 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.71 ' HD3' HD13 ' A' ' 122' ' ' LEU . 11.8 mtp180 -61.23 -58.66 7.37 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 120.859 0.362 . . . . 2.6699999999999999 110.639 178.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.661 HG22 ' SD ' ' A' ' 130' ' ' MET . 71.2 mt -51.77 -52.62 21.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.545 -0.752 . . . . 0.23000000000000001 110.043 179.257 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.802 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.19 -36.31 68.23 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.945 0.402 . . . . 0.28999999999999998 111.627 179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.829 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -63.59 -59.64 4.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.219 0.533 . . . . 0.28000000000000003 110.499 176.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 68.7 m95 -67.36 -22.74 65.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.887 -1.051 . . . . 3.9100000000000001 111.504 -174.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.661 ' SD ' HG22 ' A' ' 126' ' ' ILE . 85.9 mtp -69.24 -54.11 16.44 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.679 0.276 . . . . 1.0800000000000001 111.244 175.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.456 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -67.11 -33.17 74.89 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.506 -0.316 . . . . 0.25 110.844 -177.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 97.6 m -63.8 -45.14 91.04 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.672 -0.411 . . . . 0.40000000000000002 110.884 175.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -57.91 -41.97 83.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.034 0.445 . . . . 3.1299999999999999 110.04 176.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.94 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.5 OUTLIER -57.38 -58.11 9.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.728 -0.669 . . . . 0.94999999999999996 109.663 172.242 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -45.22 -55.28 5.98 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.036 -0.984 . . . . 0.46000000000000002 112.631 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -76.21 -53.33 8.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.994 0.426 . . . . 0.58999999999999997 111.853 -173.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.79 -50.27 5.83 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.774 0.657 . . . . 1.45 112.774 -169.241 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.94 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -76.55 -47.35 22.88 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 113.629 0.974 . . . . 1.2 113.629 -167.453 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.594 ' HA ' HD12 ' A' ' 142' ' ' ILE . 18.7 tt0 -45.24 -52.36 21.4 Favored Pre-proline 0 CA--C 1.538 0.511 0 O-C-N 123.965 0.791 . . . . 0.75 112.785 -170.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.555 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 31.3 Cg_exo -58.52 -45.21 31.52 Favored 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 121.704 1.603 . . . . 0.56000000000000005 111.689 178.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . 0.679 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.8 OUTLIER -58.78 -52.07 67.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.174 -0.921 . . . . 1.2 110.846 179.137 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.595 HD13 ' NE1' ' A' ' 148' ' ' TRP . 59.1 mt -45.62 -52.52 2.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.661 -0.7 . . . . 0.32000000000000001 111.768 175.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.573 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.7 mm-40 -58.32 -34.44 70.6 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.812 -0.631 . . . . 0.56999999999999995 111.34 -179.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 10.8 mm-40 -64.03 -22.9 67.12 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.118 0.485 . . . . 0.78000000000000003 111.103 177.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.643 ' N ' HD22 ' A' ' 145' ' ' ASN . 0.7 OUTLIER -100.9 -7.45 23.45 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.655 -0.702 . . . . 0.93000000000000005 109.575 -173.554 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 134.99 -36.96 2.0 Allowed Glycine 0 N--CA 1.44 -1.034 0 CA-C-N 115.358 -0.837 . . . . 0.56000000000000005 112.772 176.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 120.16 175.22 15.55 Favored Glycine 0 N--CA 1.449 -0.44 0 N-CA-C 111.146 -0.781 . . . . 0.48999999999999999 111.146 -175.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.595 ' NE1' HD13 ' A' ' 142' ' ' ILE . 4.8 m-90 -67.48 -33.72 75.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.339 0.569 . . . . 3.5699999999999998 111.319 -176.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.413 ' O ' ' HG3' ' A' ' 153' ' ' GLU . 9.7 m-20 -58.98 -40.06 83.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.119 0.485 . . . . 1.96 110.233 177.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.536 ' O ' ' HB2' ' A' ' 153' ' ' GLU . 55.3 m -55.54 -37.33 67.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.392 -0.822 . . . . 0.67000000000000004 112.224 177.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.425 ' HA ' ' HZ2' ' A' ' 97' ' ' TRP . 10.5 m-85 -61.47 -39.84 92.36 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.459 -0.497 . . . . 3.0 110.356 -178.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.755 HG12 ' HA ' ' A' ' 46' ' ' VAL . 0.8 OUTLIER -75.42 -26.11 18.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.074 -0.512 . . . . 1.1499999999999999 110.004 177.764 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.536 ' HB2' ' O ' ' A' ' 150' ' ' THR . 70.2 mt-10 -58.08 -30.35 66.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.243 -0.435 . . . . 1.6699999999999999 110.483 171.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.53 HD12 ' CE2' ' A' ' 97' ' ' TRP . 3.4 mt -98.65 -56.7 2.38 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.23 -0.441 . . . . 1.3 111.023 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . 0.54 ' HB2' ' HH2' ' A' ' 97' ' ' TRP . 3.1 m-85 -120.59 28.47 7.96 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.174 -0.466 . . . . 4.2400000000000002 111.098 -173.528 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.641 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -62.9 157.49 38.9 Favored Glycine 0 CA--C 1.498 -0.997 0 C-N-CA 120.654 -0.784 . . . . 1.1000000000000001 112.699 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.611 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 20.1 t-20 . . . . . 0 C--N 1.308 -1.197 0 CA-C-N 114.286 -0.957 . . . . 1.29 109.449 174.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . 1.008 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.534 1.223 0 N-CA-C 113.588 0.195 . . . . 1.2 113.588 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -86.23 -52.32 5.72 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.462 -0.434 . . . . 2.8799999999999999 111.344 171.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -71.38 -55.02 8.79 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 113.012 0.745 . . . . 1.3100000000000001 113.012 -170.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.57 ' HG ' HG13 ' A' ' 86' ' ' VAL . 3.3 mm? -59.75 -56.52 20.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.584 -0.28 . . . . 1.3300000000000001 110.679 -177.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 1.03 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -41.18 -48.83 3.51 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.899 0.749 . . . . 0.88 111.578 173.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -65.19 -55.22 19.82 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 114.427 -1.26 . . . . 1.03 111.786 -177.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -66.05 -24.92 66.83 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.024 0.44 . . . . 1.6699999999999999 110.945 -178.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.44 -5.27 72.17 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.807 -0.633 . . . . 0.78000000000000003 113.07 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 21.7 t70 -80.3 -20.73 43.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.264 0.554 . . . . 1.8999999999999999 110.114 175.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 9.7 m . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 115.89 -0.595 . . . . 1.4399999999999999 112.121 -172.33 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 70.4 mm-40 . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.847 0.356 . . . . 2.4199999999999999 111.141 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.8 p -66.55 -18.99 65.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.107 -0.497 . . . . 1.25 111.473 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.656 ' HA ' HD22 ' A' ' 8' ' ' LEU . 72.7 m-20 -64.27 -23.92 67.48 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.072 0.463 . . . . 1.78 110.19 176.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.969 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.2 tpp180 -56.88 -55.49 33.78 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.512 -0.767 . . . . 1.3999999999999999 110.143 175.336 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.658 ' HB3' ' CE ' ' A' ' 47' ' ' LYS . 43.8 mt-10 -53.58 -49.93 66.69 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.409 -1.269 . . . . 0.68000000000000005 111.434 -177.293 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.656 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.4 OUTLIER -51.91 -33.96 39.38 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.963 -1.017 . . . . 1.1599999999999999 112.12 178.531 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.545 HG22 ' HE1' ' A' ' 104' ' ' PHE . 64.5 t -78.6 -59.35 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.719 0.771 . . . . 0.27000000000000002 109.485 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.49 HG13 ' CE2' ' A' ' 24' ' ' TRP . 73.3 t -48.32 -57.32 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 114.223 -1.353 . . . . 0.33000000000000002 113.099 -176.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -59.03 -31.77 69.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.698 0.285 . . . . 0.58999999999999997 110.721 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.607 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.6 t80 -75.97 -44.62 38.94 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 116.265 -0.425 . . . . 1.6100000000000001 110.444 -179.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.908 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.3 mp -60.43 -42.29 95.76 Favored 'General case' 0 CA--C 1.52 -0.185 0 C-N-CA 120.377 -0.529 . . . . 0.34000000000000002 110.363 176.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.437 ' HA ' HD12 ' A' ' 17' ' ' LEU . 15.8 t -62.13 -40.2 95.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.097 -0.501 . . . . 1.05 109.89 177.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -59.71 -29.84 68.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.601 -0.727 . . . . 1.22 110.769 178.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.572 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 17.4 mmmt -78.6 -50.62 11.19 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.558 0.694 . . . . 1.4099999999999999 110.506 -179.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.602 HD21 ' SG ' ' A' ' 111' ' ' CYS . 12.5 mt -56.52 -28.03 58.94 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 115.444 -0.798 . . . . 1.3500000000000001 111.853 176.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.7 m -56.29 -44.67 80.06 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 112.362 0.504 . . . . 0.93999999999999995 112.362 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 14.8 pt20 -75.46 0.12 18.23 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.31 0.576 . . . . 1.3700000000000001 111.368 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.5 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.6 mmmt -109.53 -30.08 8.1 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.769 0.795 . . . . 2.2000000000000002 109.199 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.99 24.06 9.35 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 114.134 -1.394 . . . . 0.53000000000000003 111.139 178.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -115.2 160.5 19.65 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.079 0.466 . . . . 0.76000000000000001 111.23 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.7 t -101.17 147.65 26.0 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.391 -0.822 . . . . 0.52000000000000002 109.628 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.49 ' CE2' HG13 ' A' ' 10' ' ' VAL . 0.5 OUTLIER -79.31 -44.53 21.45 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.355 -0.609 . . . . 3.3599999999999999 109.355 173.773 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.454 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 6.3 p -64.65 -32.94 74.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.384 -0.826 . . . . 1.3700000000000001 111.76 -172.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -59.62 -24.29 63.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.136 0.493 . . . . 1.1100000000000001 111.698 178.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.571 ' O ' ' HB2' ' A' ' 124' ' ' SER . 22.2 m-85 -120.46 13.57 11.82 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.898 -0.592 . . . . 1.28 110.897 -175.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.579 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 60.3 p -101.11 -178.53 3.77 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.923 0.712 . . . . 1.8100000000000001 112.923 -170.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.599 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 4.2 t70 -170.54 -26.93 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.324 -1.307 . . . . 2.3100000000000001 109.359 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.842 HG23 ' H ' ' A' ' 31' ' ' GLU . 10.7 m -45.16 -70.68 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-N 114.424 -1.262 . . . . 0.92000000000000004 113.075 -173.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.842 ' H ' HG23 ' A' ' 30' ' ' VAL . 7.9 pt-20 -100.79 2.28 41.06 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.179 -0.675 . . . . 2.7400000000000002 109.179 176.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.599 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.7 tt0 . . . . . 0 N--CA 1.45 -0.433 0 CA-C-N 114.798 -1.092 . . . . 1.45 111.38 -175.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.876 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.6 t . . . . . 0 CA--C 1.536 0.424 0 CA-C-O 120.831 0.348 . . . . 1.1200000000000001 110.313 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.876 ' H ' HG23 ' A' ' 41' ' ' THR . 3.6 pt-20 -94.15 -28.87 15.44 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.281 1.039 . . . . 2.02 108.48 167.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.45 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.0 OUTLIER -56.34 -38.52 71.47 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 112.829 -1.987 . . . . 1.25 113.686 -169.826 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.508 ' HA ' ' CD ' ' A' ' 47' ' ' LYS . 13.8 tp10 -47.9 -56.1 8.33 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 117.903 0.319 . . . . 1.9099999999999999 110.757 -174.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.512 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -66.14 -40.19 90.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.833 0.349 . . . . 0.52000000000000002 110.743 178.096 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.761 ' HA ' HG12 ' A' ' 152' ' ' VAL . 84.8 t -56.75 -59.94 2.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.572 0.701 . . . . 1.4099999999999999 111.134 178.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.658 ' CE ' ' HB3' ' A' ' 7' ' ' GLU . 4.2 ptmt -64.53 -30.77 71.8 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.811 -1.086 . . . . 0.67000000000000004 109.837 -176.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.773 ' HB3' ' HB3' ' A' ' 157' ' ' ASN . 8.2 mm100 -72.91 -27.35 61.81 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.566 -0.743 . . . . 0.98999999999999999 110.882 177.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.659 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -79.7 -34.61 40.03 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.127 0.489 . . . . 0.41999999999999998 109.814 175.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mp -62.73 -35.8 80.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.339 -0.846 . . . . 1.3300000000000001 112.218 -178.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.572 ' HD3' ' NE2' ' A' ' 48' ' ' GLN . 11.6 ptm180 -68.99 -36.23 77.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.713 0.768 . . . . 2.1699999999999999 109.585 178.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.559 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 6.6 mt-10 -80.74 -37.29 30.75 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.874 -1.057 . . . . 1.1000000000000001 110.811 -174.198 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.42 -34.77 72.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.742 -0.663 . . . . 0.53000000000000003 109.667 171.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.58 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.92 -50.69 61.55 Favored Glycine 0 C--O 1.223 -0.593 0 CA-C-N 115.342 -0.844 . . . . 0.69999999999999996 112.431 179.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.607 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 28.1 t70 -54.29 -36.36 63.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.24 0.543 . . . . 1.04 111.099 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.533 ' O ' HD11 ' A' ' 59' ' ' LEU . 4.3 tt0 -76.98 -27.6 54.79 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.422 -0.808 . . . . 2.29 110.867 -178.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.485 ' CE1' ' HA2' ' B' 1012 ' ' GLY . 0.1 OUTLIER -82.87 -54.12 5.34 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.773 -0.649 . . . . 2.29 111.791 178.965 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.61 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 17.2 mt-10 -55.39 -54.5 42.91 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.975 0.731 . . . . 1.3 112.975 -168.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.731 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -42.48 -41.31 2.9 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.739 1.014 . . . . 1.54 113.739 -172.862 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.731 ' H ' HD12 ' A' ' 59' ' ' LEU . 36.4 mtm180 -59.41 -59.45 5.42 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 111.939 0.348 . . . . 2.5800000000000001 111.939 -176.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.61 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -91.77 -5.67 53.14 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.052 0.76 . . . . 5.3200000000000003 113.052 -175.352 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 24.6 ptt180 -66.42 -15.09 63.05 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 122.246 -0.284 . . . . 4.4800000000000004 111.539 -175.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 63' ' ' ARG . 37.7 mtm105 -67.87 -15.95 63.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.243 -0.435 . . . . 4.7199999999999998 111.438 179.336 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.744 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.38 -35.06 13.91 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.585 0.217 . . . . 1.1699999999999999 111.585 175.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.653 ' HE1' HD11 ' B' 1008 ' ' LEU . 9.6 m-30 -43.32 -50.53 6.63 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.141 1.163 . . . . 2.8100000000000001 114.141 -168.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.6 m -72.79 -20.53 61.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.101 0.477 . . . . 2.1899999999999999 111.41 -171.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -90.41 -23.98 20.89 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.785 -0.643 . . . . 2.7200000000000002 110.297 178.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.744 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 70.1 mt -77.65 -16.06 58.78 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 113.012 0.745 . . . . 1.5600000000000001 113.012 -173.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.572 HG22 HG13 ' A' ' 74' ' ' ILE . 3.5 p -56.15 -28.9 59.78 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.27 0.47 . . . . 0.69999999999999996 112.27 -172.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.2 t -67.37 -36.62 81.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.39 0.614 . . . . 1.3400000000000001 109.823 175.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.603 ' NE2' HD22 ' A' ' 68' ' ' LEU . 17.1 mt-30 -72.43 -41.59 66.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.321 -0.854 . . . . 1.4199999999999999 109.765 177.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.433 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.5 mm? -65.71 -32.2 73.61 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.05 -0.523 . . . . 1.3700000000000001 110.921 176.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.423 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 38.6 m80 63.9 40.44 7.41 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.887 -0.783 . . . . 2.7200000000000002 108.887 -173.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.576 HG21 ' HB3' ' A' ' 113' ' ' GLU . 35.9 mm -49.62 113.74 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-N 114.447 -1.251 . . . . 0.91000000000000003 111.441 -178.198 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.775 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.81 -170.37 0.24 Allowed Pre-proline 0 CA--C 1.548 0.887 0 N-CA-C 107.922 -1.14 . . . . 0.51000000000000001 107.922 -168.633 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.775 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.3 Cg_exo -28.71 166.88 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.089 1 C-N-CA 125.407 4.072 . . . . 0.46999999999999997 115.537 162.857 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.87 -29.18 0.01 OUTLIER Glycine 0 N--CA 1.472 1.053 0 N-CA-C 117.261 1.664 . . . . 0.40000000000000002 117.261 -173.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 81' ' ' GLN . 32.9 p -68.51 3.36 1.84 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 117.93 0.865 . . . . 0.56000000000000005 111.997 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.64 -13.39 61.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.339 0.59 . . . . 0.34000000000000002 109.564 170.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.435 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 50.2 t80 -75.45 -18.43 59.88 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 115.703 -0.68 . . . . 4.1299999999999999 109.234 173.289 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.525 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 74.2 mt-30 -80.42 -26.99 38.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 122.199 1.0 . . . . 1.03 109.416 172.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m -78.09 -33.05 50.93 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.188 -1.369 . . . . 0.47999999999999998 110.039 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.675 ' HB2' ' HG ' ' A' ' 110' ' ' LEU . 67.7 t80 -80.42 -17.07 52.89 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.583 0.706 . . . . 1.1799999999999999 109.378 172.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.582 ' HA ' HG12 ' A' ' 87' ' ' VAL . 35.3 tt0 -68.2 -57.99 5.14 Favored 'General case' 0 CA--C 1.498 -1.054 0 CA-C-N 115.109 -0.95 . . . . 0.80000000000000004 111.178 -174.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.573 ' HG3' ' N ' ' A' ' 86' ' ' VAL . 3.2 pt20 -43.95 -38.88 3.69 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 113.557 -1.656 . . . . 1.6200000000000001 110.932 178.236 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.587 HG21 ' CE2' ' A' ' 106' ' ' PHE . 1.5 t -78.28 -53.94 13.11 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.734 0 CA-C-N 112.465 -2.152 . . . . 1.3 111.142 -177.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.582 HG12 ' HA ' ' A' ' 84' ' ' GLU . 8.6 p -60.73 -21.61 24.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 122.057 0.932 . . . . 0.84999999999999998 109.445 -178.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.455 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 2.7 m-80 -70.96 -43.77 67.42 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 113.897 -1.501 . . . . 0.91000000000000003 111.34 173.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.629 ' OE1' ' HA ' ' B' 1009 ' ' ALA . 2.0 pp20? -73.01 -37.56 66.92 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 121.767 0.794 . . . . 2.8700000000000001 109.055 177.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.911 HD12 HH11 ' A' ' 99' ' ' ARG . 3.5 tp -66.74 -19.82 65.83 Favored 'General case' 0 N--CA 1.433 -1.31 0 CA-C-N 113.731 -1.577 . . . . 1.28 112.015 -165.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.652 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 2.6 p90 -110.64 -28.82 8.29 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 120.524 -0.471 . . . . 2.2999999999999998 112.0 -173.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.549 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 9.9 ptm180 -72.94 -39.31 66.33 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.289 0.566 . . . . 5.0599999999999996 111.534 -171.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -88.93 13.44 12.76 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.269 -0.878 . . . . 3.1200000000000001 113.361 -169.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.593 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 128.46 70.66 0.14 Allowed Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 116.952 -2.547 . . . . 2.3100000000000001 115.459 178.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.652 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 75.0 t -72.06 104.48 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 118.417 1.109 . . . . 1.0600000000000001 111.066 178.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -111.24 -170.22 1.6 Allowed 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.224 -1.353 . . . . 2.1200000000000001 108.712 177.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 10.8 m-90 -56.1 -46.35 79.11 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 123.515 0.509 . . . . 3.3399999999999999 111.192 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -79.05 -30.62 46.13 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.957 -0.64 . . . . 0.68999999999999995 113.938 -175.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.911 HH11 HD12 ' A' ' 90' ' ' LEU . 16.6 mmt180 -55.61 -42.44 74.89 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 117.216 0.508 . . . . 4.2400000000000002 111.553 -178.03 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.574 HG22 ' CE2' ' A' ' 104' ' ' PHE . 55.0 mt -67.8 -38.57 80.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.969 -0.56 . . . . 0.44 110.678 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 52.0 t -53.97 -54.18 22.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.937 -0.574 . . . . 1.3500000000000001 110.033 172.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.4 ' O ' ' HB3' ' A' ' 105' ' ' SER . . . -55.68 -40.62 72.56 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.503 -0.772 . . . . 0.44 111.227 177.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.4 ' CD1' HG23 ' A' ' 87' ' ' VAL . 6.7 t80 -58.9 -40.96 86.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.372 -0.831 . . . . 1.49 111.069 177.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.574 ' CE2' HG22 ' A' ' 100' ' ' ILE . 39.1 m-85 -71.11 -34.09 70.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.694 0.283 . . . . 3.29 110.506 175.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.607 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 25.3 t -58.95 -57.49 12.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.078 -0.51 . . . . 1.1899999999999999 111.127 178.165 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.587 ' CE2' HG21 ' A' ' 86' ' ' VAL . 34.6 t80 -68.11 -31.89 71.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 2.8900000000000001 110.231 -178.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.483 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -67.3 -46.21 73.09 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.786 -0.721 . . . . 0.29999999999999999 111.785 177.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.908 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.56 -31.98 81.84 Favored Glycine 0 N--CA 1.441 -0.982 0 C-N-CA 120.646 -0.787 . . . . 0.23000000000000001 111.148 176.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.45 -30.56 67.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.577 -0.311 . . . . 0.31 110.526 175.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.675 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -65.02 -42.54 94.3 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 107.974 -1.121 . . . . 1.1200000000000001 107.974 178.795 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.735 ' SG ' HG22 ' A' ' 123' ' ' VAL . 38.2 t -52.74 -54.8 28.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.101 -1.409 . . . . 0.26000000000000001 110.479 172.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.5 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 73.8 t -62.97 -42.78 97.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.202 -0.453 . . . . 0.34999999999999998 111.864 -177.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.576 ' HB3' HG21 ' A' ' 74' ' ' ILE . 3.4 mm-40 -59.08 -29.13 67.11 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.606 -0.438 . . . . 2.5099999999999998 110.991 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.401 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 47.7 m -73.31 -39.23 65.45 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.963 -0.754 . . . . 0.28000000000000003 108.963 176.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.639 ' HA ' ' HG3' ' A' ' 120' ' ' GLN . 80.5 t -67.07 -38.13 80.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.213 -0.903 . . . . 1.23 109.397 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -52.75 -50.44 63.48 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 113.364 -1.744 . . . . 0.59999999999999998 111.338 -179.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 113' ' ' GLU . 20.7 mmtt -88.18 16.18 6.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.137 -0.483 . . . . 1.6200000000000001 110.394 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.568 ' HA ' HE21 ' A' ' 120' ' ' GLN . 45.5 mt-10 63.87 49.32 2.89 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.82 0.819 . . . . 1.8799999999999999 110.729 178.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.564 ' HE1' HG22 ' A' ' 74' ' ' ILE . 26.4 mtm -130.67 44.69 2.92 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.627 -1.17 . . . . 0.31 108.203 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.639 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 3.4 mp0 -62.45 -6.99 3.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.283 -0.871 . . . . 1.1499999999999999 112.958 -173.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.537 HG23 HD22 ' A' ' 122' ' ' LEU . 26.6 m -66.01 -21.85 29.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 O-C-N 122.14 -0.35 . . . . 0.46000000000000002 111.577 176.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.688 HD13 ' HD3' ' A' ' 125' ' ' ARG . 3.3 mm? -75.53 -25.24 57.02 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 110.291 -0.263 . . . . 0.26000000000000001 110.291 178.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.735 HG22 ' SG ' ' A' ' 111' ' ' CYS . 49.6 t -43.86 -53.63 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 123.917 0.761 . . . . 0.25 112.059 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.579 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 12.6 t -71.99 -37.77 69.8 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.853 -0.339 . . . . 1.3500000000000001 110.718 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.688 ' HD3' HD13 ' A' ' 122' ' ' LEU . 63.7 mtp180 -61.0 -56.52 20.11 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.305 -0.407 . . . . 2.6699999999999999 110.512 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.59 HG22 ' SD ' ' A' ' 130' ' ' MET . 70.7 mt -52.25 -50.67 36.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.807 -0.633 . . . . 0.23000000000000001 110.305 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.8 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -57.18 -36.17 70.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.851 0.358 . . . . 0.28999999999999998 111.378 179.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.969 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -63.54 -57.69 9.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.311 0.577 . . . . 0.28000000000000003 110.556 176.137 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -66.72 -26.9 67.23 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.719 -1.128 . . . . 3.9100000000000001 111.197 -174.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.59 ' SD ' HG22 ' A' ' 126' ' ' ILE . 89.7 mtp -69.23 -53.99 17.05 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.081 0.467 . . . . 1.0800000000000001 110.972 175.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.511 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -59.33 -39.26 82.59 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.8 -0.636 . . . . 0.25 111.073 -178.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 86.7 m -63.56 -47.32 82.04 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.763 -0.375 . . . . 0.40000000000000002 111.022 176.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.589 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 12.1 t80 -55.43 -39.35 70.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.178 0.514 . . . . 3.1299999999999999 109.847 178.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.883 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.3 OUTLIER -59.91 -60.71 3.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.821 -0.627 . . . . 0.94999999999999996 109.855 170.833 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -45.94 -44.36 14.72 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.054 -0.975 . . . . 0.46000000000000002 113.245 -179.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -86.14 -51.87 6.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.989 0.423 . . . . 0.58999999999999997 112.047 -178.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . 0.589 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 8.7 m80 -89.54 -49.7 6.52 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.889 0.7 . . . . 1.45 112.889 -168.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.883 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -76.71 -44.82 31.94 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 113.0 0.741 . . . . 1.2 113.0 -169.906 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.618 ' HA ' HD12 ' A' ' 142' ' ' ILE . 17.6 tt0 -42.23 -53.57 8.6 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.106 -0.952 . . . . 0.75 113.254 -171.576 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.545 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 24.3 Cg_exo -63.11 -42.55 22.76 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 121.76 1.64 . . . . 0.56000000000000005 111.634 178.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . 0.507 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -56.8 -48.71 77.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.283 -0.871 . . . . 1.2 110.421 177.514 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.618 HD12 ' HA ' ' A' ' 139' ' ' GLU . 42.6 mt -49.76 -49.71 19.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.266 -0.879 . . . . 0.32000000000000001 111.455 175.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.5 mm-40 -58.86 -32.64 69.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.543 -0.753 . . . . 0.56999999999999995 111.355 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.1 mm-40 -66.42 -19.45 65.8 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.304 0.574 . . . . 0.78000000000000003 111.1 176.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.623 ' N ' HD22 ' A' ' 145' ' ' ASN . 0.7 OUTLIER -108.0 3.25 23.86 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.469 -0.787 . . . . 0.93000000000000005 109.522 -175.759 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.32 -49.17 0.89 Allowed Glycine 0 N--CA 1.44 -1.081 0 CA-C-N 115.156 -0.929 . . . . 0.56000000000000005 112.764 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . 0.447 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 139.66 178.95 17.19 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.765 -0.731 . . . . 0.48999999999999999 111.757 -177.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.611 ' HZ2' ' HG3' ' A' ' 139' ' ' GLU . 19.0 m-90 -68.41 -42.53 78.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.694 0.283 . . . . 3.5699999999999998 110.614 -178.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 3.5 m-20 -57.75 -33.91 68.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 1.96 110.369 176.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.539 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 50.2 m -59.71 -40.77 89.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.116 -0.493 . . . . 0.67000000000000004 111.488 178.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.56 ' CD2' ' HA ' ' A' ' 148' ' ' TRP . 19.5 m-85 -59.75 -36.16 76.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.248 0.547 . . . . 3.0 109.756 -178.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.761 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.4 m -81.28 -24.54 10.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.652 -0.703 . . . . 1.1499999999999999 110.17 178.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 11.2 mm-40 -59.19 -26.68 65.01 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.123 0.487 . . . . 1.6699999999999999 109.964 171.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 150' ' ' THR . 1.4 mt -97.53 -55.22 2.89 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.718 -0.673 . . . . 1.3 110.737 179.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 56.3 m-85 -112.47 16.98 19.65 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.059 -0.518 . . . . 4.2400000000000002 111.749 -170.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.659 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -63.8 159.77 38.74 Favored Glycine 0 CA--C 1.497 -1.071 0 CA-C-O 122.605 1.114 . . . . 1.1000000000000001 115.164 -168.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.773 ' HB3' ' HB3' ' A' ' 48' ' ' GLN . 46.5 t-20 . . . . . 0 N--CA 1.426 -1.652 0 CA-C-N 112.599 -1.8 . . . . 1.29 109.68 -174.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.124 0 N-CA-C 113.829 0.292 . . . . 1.2 113.829 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -98.43 -13.59 20.51 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 113.027 0.751 . . . . 2.8799999999999999 113.027 177.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -97.13 -53.09 3.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.306 0.484 . . . . 1.3100000000000001 112.306 -170.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.653 HD11 ' HE1' ' A' ' 65' ' ' PHE . 2.7 mm? -64.38 -46.93 81.24 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.832 -0.803 . . . . 1.3300000000000001 108.832 178.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 0.629 ' HA ' ' OE1' ' A' ' 89' ' ' GLU . . . -38.96 -51.8 1.79 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.326 -1.306 . . . . 0.88 111.739 167.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -77.67 -55.6 5.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.536 -1.211 . . . . 1.03 111.975 -173.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -66.02 -21.74 66.41 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.157 -0.474 . . . . 1.6699999999999999 110.692 -178.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . 0.485 ' HA2' ' CE1' ' A' ' 57' ' ' PHE . . . -80.27 -5.61 89.64 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.836 -0.62 . . . . 0.78000000000000003 112.796 -179.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.8 t70 -82.65 -8.78 59.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.323 0.583 . . . . 1.8999999999999999 109.892 174.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 3.2 m . . . . . 0 N--CA 1.45 -0.471 0 N-CA-C 108.488 -0.93 . . . . 1.4399999999999999 108.488 -179.986 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.8 mp0 . . . . . 0 C--O 1.223 -0.335 0 CA-C-O 120.884 0.373 . . . . 2.4199999999999999 110.153 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.445 ' O ' HD13 ' A' ' 8' ' ' LEU . 1.7 p -60.27 -23.29 64.01 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.838 -0.619 . . . . 1.25 112.03 -179.071 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.576 ' HA ' HD22 ' A' ' 8' ' ' LEU . 3.9 p30 -67.58 -22.32 65.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.931 -0.577 . . . . 1.78 111.115 176.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.843 HH12 ' HA ' ' A' ' 128' ' ' ALA . 23.9 tpp180 -58.23 -50.69 72.67 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.235 0.541 . . . . 1.3999999999999999 109.864 175.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.511 ' OE1' ' HB2' ' A' ' 43' ' ' SER . 33.6 mt-10 -50.62 -55.71 15.13 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.324 -1.307 . . . . 0.68000000000000005 110.808 -179.084 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.576 HD22 ' HA ' ' A' ' 5' ' ' ASN . 2.8 mp -43.61 -45.97 7.01 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.151 -0.931 . . . . 1.1599999999999999 111.345 176.694 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.5 t -70.2 -60.74 2.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.121 0.486 . . . . 0.27000000000000002 110.662 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 6' ' ' ARG . 63.7 t -53.57 -53.46 25.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.482 -0.781 . . . . 0.33000000000000002 112.477 -175.275 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -54.25 -35.37 62.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.483 -0.78 . . . . 0.58999999999999997 111.126 -175.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.57 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 15.2 t80 -88.34 -37.33 16.03 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 120.478 -0.489 . . . . 1.6100000000000001 112.14 -175.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 1.013 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 2.8 mp -60.43 -36.93 79.34 Favored 'General case' 0 CA--C 1.521 -0.152 0 C-N-CA 119.386 -0.926 . . . . 0.34000000000000002 109.301 176.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.528 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 35.7 t -63.35 -37.37 87.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.642 -0.708 . . . . 1.05 110.354 175.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -71.41 -26.09 62.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.666 -0.697 . . . . 1.22 110.48 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.57 ' HG2' ' O ' ' A' ' 12' ' ' PHE . 12.8 mmmt -75.86 -43.15 47.06 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 112.133 0.42 . . . . 1.4099999999999999 112.133 -179.227 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.58 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -59.53 -19.08 45.74 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.672 0.272 . . . . 1.3500000000000001 111.327 177.139 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.1 t -60.37 -44.32 95.71 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.322 0.489 . . . . 0.93999999999999995 112.322 -176.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -66.97 -10.54 50.51 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.631 0.729 . . . . 1.3700000000000001 111.673 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.417 ' HD3' HG11 ' A' ' 112' ' ' VAL . 19.8 mmmt -105.85 -30.2 9.53 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 122.079 0.942 . . . . 2.2000000000000002 108.936 -177.286 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.17 19.34 21.6 Favored Glycine 0 N--CA 1.442 -0.948 0 CA-C-N 114.297 -1.32 . . . . 0.53000000000000003 111.622 175.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -102.38 162.88 12.57 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.771 0.319 . . . . 0.76000000000000001 110.852 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.2 t -98.11 149.86 22.06 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 115.961 -0.563 . . . . 0.52000000000000002 110.397 178.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.596 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 52.4 t-105 -77.84 -52.72 8.44 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.225 -0.898 . . . . 3.3599999999999999 109.968 174.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.7 m -68.49 -22.16 64.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.823 -0.626 . . . . 1.3700000000000001 112.248 -172.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -67.2 -27.69 67.47 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.745 -0.382 . . . . 1.1100000000000001 111.73 178.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -115.58 -8.48 12.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.215 -0.448 . . . . 1.28 111.894 -174.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.639 ' HB3' HG22 ' A' ' 30' ' ' VAL . 49.5 m -101.66 154.34 18.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.715 0.769 . . . . 1.8100000000000001 113.066 -174.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.534 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.8 t70 -115.58 -14.8 11.48 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 113.879 -1.509 . . . . 2.3100000000000001 109.828 -179.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.856 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.0 m -48.48 -73.01 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.463 -1.244 . . . . 0.92000000000000004 113.092 -167.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.856 ' H ' HG23 ' A' ' 30' ' ' VAL . 44.2 mt-10 -92.14 0.89 57.47 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.561 -0.533 . . . . 2.7400000000000002 109.561 176.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.534 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.9 tt0 . . . . . 0 N--CA 1.45 -0.466 0 CA-C-N 115.547 -0.751 . . . . 1.45 110.482 -178.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.833 HG23 ' H ' ' A' ' 42' ' ' GLU . 2.2 t . . . . . 0 CA--C 1.538 0.509 0 CA-C-O 120.13 0.014 . . . . 1.1200000000000001 111.022 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.833 ' H ' HG23 ' A' ' 41' ' ' THR . 13.9 pt-20 -92.91 -30.99 15.11 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 122.374 1.083 . . . . 2.02 109.454 174.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.805 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 66.3 m -69.84 -16.63 63.29 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 113.218 -1.81 . . . . 1.25 114.323 -167.159 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -42.81 -41.85 3.39 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 118.254 0.479 . . . . 1.9099999999999999 111.831 -178.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.44 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -83.65 -42.29 16.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.075 0.464 . . . . 0.52000000000000002 110.47 174.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.701 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 75.9 t -46.95 -66.91 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 C-N-CA 124.05 0.94 . . . . 1.4099999999999999 111.857 175.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.805 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.7 ptpt -61.27 -38.1 85.52 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.742 -0.663 . . . . 0.67000000000000004 110.462 -177.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.753 HE21 ' HA ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.61 -27.23 66.12 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 116.233 -0.44 . . . . 0.98999999999999999 110.958 175.365 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.812 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -83.84 -45.75 12.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.235 0.541 . . . . 0.41999999999999998 110.413 172.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.686 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -49.05 -42.25 37.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.826 -1.079 . . . . 1.3300000000000001 112.003 -179.697 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.649 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.4 ptp180 -76.88 -28.45 55.4 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.336 0.589 . . . . 2.1699999999999999 110.017 -170.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.438 ' HG2' ' HG3' ' A' ' 51' ' ' ARG . 19.1 mm-40 -77.85 -44.18 28.05 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.911 -1.041 . . . . 1.1000000000000001 110.182 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.21 -43.46 98.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.665 -0.698 . . . . 0.53000000000000003 109.695 174.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.699 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.87 -41.46 99.87 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-N 115.556 -0.747 . . . . 0.69999999999999996 111.48 175.054 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -52.56 -39.3 61.32 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 122.786 0.434 . . . . 1.04 111.123 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.419 ' HA ' HD11 ' A' ' 59' ' ' LEU . 50.7 mt-10 -80.05 -27.19 39.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.12 -0.491 . . . . 2.29 111.498 178.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.908 ' HZ ' ' HA2' ' B' 1012 ' ' GLY . 1.4 t80 -80.84 -27.46 36.46 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.537 -0.301 . . . . 2.29 111.235 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.798 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 47.7 mt-10 -56.26 -65.48 0.6 Allowed 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 111.932 0.345 . . . . 1.3 111.932 -176.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.79 ' H ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -52.05 -35.44 47.31 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.323 0.39 . . . . 1.54 111.337 -178.616 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.704 ' N ' HD22 ' A' ' 59' ' ' LEU . 46.0 mtt180 -52.83 -55.18 24.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.58 -0.736 . . . . 2.5800000000000001 111.756 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.798 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 29.3 p90 -90.78 -19.68 23.21 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.682 -0.407 . . . . 5.3200000000000003 111.757 -177.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -58.81 -30.11 67.39 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 122.681 0.392 . . . . 4.4800000000000004 111.55 -174.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -62.64 -37.16 85.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 4.7199999999999998 110.685 178.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.464 ' HB1' HD13 ' A' ' 68' ' ' LEU . . . -90.41 -31.23 16.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.426 . . . . 1.1699999999999999 110.807 178.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.585 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 56.9 t80 -42.55 -48.47 5.34 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.821 0.848 . . . . 2.8100000000000001 113.199 -174.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.5 t -62.75 -38.14 89.37 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.861 0.362 . . . . 2.1899999999999999 110.945 -174.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -87.57 -28.14 22.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.0 0.429 . . . . 2.7200000000000002 110.762 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.656 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 0.5 OUTLIER -60.13 -22.5 62.91 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 113.099 0.777 . . . . 1.5600000000000001 113.099 -175.349 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.456 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 4.8 p -52.99 -26.99 17.09 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 117.999 0.363 . . . . 0.69999999999999996 111.391 -179.549 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.7 t -58.98 -58.25 9.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.377 0.608 . . . . 1.3400000000000001 110.055 173.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.891 ' H ' ' NE2' ' A' ' 71' ' ' GLN . 1.9 mp0 -51.35 -45.59 62.41 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 124.397 1.079 . . . . 1.4199999999999999 111.161 174.477 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.49 ' HB3' ' CD1' ' A' ' 74' ' ' ILE . 2.4 mm? -66.62 -31.86 72.82 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 116.056 -0.52 . . . . 1.3700000000000001 111.834 179.082 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.9 m80 57.1 42.64 25.49 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.65 -0.87 . . . . 2.7200000000000002 108.65 -174.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.508 HG22 ' HE1' ' A' ' 119' ' ' MET . 31.9 mm -49.67 115.66 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 113.582 -1.644 . . . . 0.91000000000000003 113.141 -173.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.772 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -157.04 -171.61 0.29 Allowed Pre-proline 0 CA--C 1.551 0.988 0 CA-C-N 114.272 -1.331 . . . . 0.51000000000000001 107.798 -171.796 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.772 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 41.0 Cg_exo -28.63 166.67 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.335 1 C-N-CA 125.453 4.102 . . . . 0.46999999999999997 115.976 164.895 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.416 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -31.5 -27.17 0.01 OUTLIER Glycine 0 N--CA 1.474 1.203 0 N-CA-C 117.441 1.737 . . . . 0.40000000000000002 117.441 -173.078 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.432 ' N ' ' O ' ' A' ' 76' ' ' PRO . 24.1 p -69.39 4.34 1.81 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 117.888 0.844 . . . . 0.56000000000000005 112.007 -179.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.19 -14.58 63.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 121.393 0.616 . . . . 0.34000000000000002 109.742 172.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -76.6 -14.73 59.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.687 -0.688 . . . . 4.1299999999999999 109.92 176.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.496 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 37.3 mt-30 -86.99 -24.11 24.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.623 0.725 . . . . 1.03 109.978 173.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.0 m -71.22 -51.19 26.08 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.711 -1.131 . . . . 0.47999999999999998 109.249 170.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -68.2 -15.94 63.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.82 -1.082 . . . . 1.1799999999999999 110.202 174.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.629 ' HA ' HG12 ' A' ' 87' ' ' VAL . 41.5 tt0 -64.22 -50.55 67.6 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.172 0.51 . . . . 0.80000000000000004 110.257 176.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.403 ' HG3' ' H ' ' A' ' 85' ' ' GLN . 53.4 mt-30 -44.43 -43.63 7.87 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 114.414 -1.266 . . . . 1.6200000000000001 111.302 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.676 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.6 p -91.45 -36.77 8.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 CA-C-N 113.546 -1.661 . . . . 1.3 112.039 -171.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.629 HG12 ' HA ' ' A' ' 84' ' ' GLU . 6.9 p -66.38 -21.31 28.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 121.845 0.831 . . . . 0.84999999999999998 109.277 175.333 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.609 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.5 m-80 -72.74 -51.47 19.04 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.193 -1.367 . . . . 0.91000000000000003 111.137 175.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 1.024 ' HG2' ' HA2' ' B' 1005 ' ' GLY . 0.0 OUTLIER -64.96 -40.04 94.39 Favored 'General case' 0 CA--C 1.496 -1.109 0 N-CA-C 108.77 -0.826 . . . . 2.8700000000000001 108.77 -178.622 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.618 ' HG ' ' OE1' ' A' ' 89' ' ' GLU . 15.5 mt -57.21 -27.08 61.68 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-N 113.851 -1.522 . . . . 1.28 110.8 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.621 ' HA ' HG22 ' A' ' 95' ' ' VAL . 76.4 t80 -97.4 -49.05 5.06 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.341 0.591 . . . . 2.2999999999999998 110.727 -171.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.609 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER -75.56 -32.77 60.52 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.595 -0.73 . . . . 5.0599999999999996 110.885 -173.095 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.518 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 1.4 m-20 -94.55 20.17 8.81 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.676 -0.693 . . . . 3.1200000000000001 112.549 -174.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.69 70.97 0.11 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 117.182 -2.437 . . . . 2.3100000000000001 116.116 177.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 1.042 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 46.6 t -75.88 98.86 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 118.927 1.363 . . . . 1.0600000000000001 111.271 171.714 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -113.35 -170.94 1.78 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.953 -1.021 . . . . 2.1200000000000001 109.601 177.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.685 ' HA ' ' CE2' ' A' ' 151' ' ' PHE . 13.6 m-90 -61.79 -46.7 88.42 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.112 -0.495 . . . . 3.3399999999999999 110.643 178.297 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.422 ' HA2' HG13 ' A' ' 101' ' ' VAL . . . -78.54 -20.37 71.73 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.89 -0.595 . . . . 0.68999999999999995 113.9 -174.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 1.042 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -68.91 -30.57 69.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 117.336 0.568 . . . . 4.2400000000000002 110.0 -176.335 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 85.4 mt -76.76 -32.36 20.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.329 -0.396 . . . . 0.44 110.642 -178.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.429 ' HA ' ' CD1' ' A' ' 104' ' ' PHE . 0.8 OUTLIER -63.84 -26.48 40.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-O 121.321 0.581 . . . . 1.3500000000000001 109.51 172.038 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -73.77 -49.24 26.37 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.396 -0.594 . . . . 0.44 109.396 173.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.665 ' HB2' ' NH1' ' A' ' 99' ' ' ARG . 32.7 t80 -49.93 -55.42 14.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.731 -1.122 . . . . 1.49 111.697 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.517 ' HA ' ' CE ' ' A' ' 130' ' ' MET . 0.2 OUTLIER -72.54 -18.46 61.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.974 0.416 . . . . 3.29 110.733 -174.278 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.561 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 23.0 t -81.75 -44.32 17.18 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.219 -0.446 . . . . 1.1899999999999999 110.524 177.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.566 ' CZ ' HD12 ' B' 1008 ' ' LEU . 19.9 m-30 -65.41 -39.92 92.74 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 116.441 -0.345 . . . . 2.8900000000000001 110.107 178.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . 0.839 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -64.49 -37.25 94.19 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.821 -0.704 . . . . 0.29999999999999999 111.673 176.695 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 1.013 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.9 -34.56 87.5 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 120.539 -0.839 . . . . 0.23000000000000001 111.407 175.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.585 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -72.23 -34.1 68.06 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.8 0.333 . . . . 0.31 110.463 176.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.565 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -60.65 -40.14 90.93 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 122.21 1.005 . . . . 1.1200000000000001 108.514 179.564 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.692 ' HB2' HD23 ' A' ' 13' ' ' LEU . 33.3 t -52.74 -53.92 41.11 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 113.74 -1.573 . . . . 0.26000000000000001 110.344 173.322 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.417 HG11 ' HD3' ' A' ' 20' ' ' LYS . 54.4 t -61.21 -42.32 92.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.031 -0.531 . . . . 0.34999999999999998 111.54 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.487 ' HB3' HG21 ' A' ' 74' ' ' ILE . 32.1 mt-10 -55.41 -34.11 64.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.053 0.454 . . . . 2.5099999999999998 110.797 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.447 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 30.3 m -74.14 -38.09 63.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.466 0.65 . . . . 0.28000000000000003 109.268 178.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.644 ' HA ' ' HG3' ' A' ' 120' ' ' GLN . 85.9 t -67.51 -34.29 67.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 115.127 -0.942 . . . . 1.23 109.538 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.48 -50.31 60.1 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.594 -1.639 . . . . 0.59999999999999998 111.381 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 10.6 mmtp -89.74 11.9 18.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.03 -0.532 . . . . 1.6200000000000001 110.541 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 61.8 56.29 2.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.93 0.871 . . . . 1.8799999999999999 110.588 -176.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.508 ' HE1' HG22 ' A' ' 74' ' ' ILE . 32.7 mtm -129.44 43.68 3.1 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.388 -1.278 . . . . 0.31 107.61 178.034 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.644 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 14.1 mp0 -61.35 -7.14 2.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.877 -1.056 . . . . 1.1499999999999999 113.199 -172.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.597 HG23 HD22 ' A' ' 122' ' ' LEU . 17.9 m -62.94 -28.53 45.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 O-C-N 121.916 -0.49 . . . . 0.46000000000000002 111.187 173.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.755 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.4 mm? -69.36 -28.08 65.89 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 110.267 -0.271 . . . . 0.26000000000000001 110.267 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.691 HG22 ' SG ' ' A' ' 111' ' ' CYS . 54.7 t -43.04 -53.91 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 O-C-N 123.955 0.784 . . . . 0.25 112.124 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.604 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 3.3 t -75.1 -34.89 61.78 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.877 0.37 . . . . 1.3500000000000001 110.662 -178.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.755 ' HD2' HD13 ' A' ' 122' ' ' LEU . 93.0 mtt180 -64.22 -50.28 68.63 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.081 -0.509 . . . . 2.6699999999999999 110.803 -177.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.565 HD13 ' HB3' ' A' ' 110' ' ' LEU . 75.8 mt -55.12 -50.03 67.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.675 -0.693 . . . . 0.23000000000000001 110.614 179.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.596 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -56.7 -34.2 67.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.408 -0.36 . . . . 0.28999999999999998 111.639 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.843 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -59.41 -61.93 2.26 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.36 0.6 . . . . 0.28000000000000003 110.448 175.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -62.17 -31.87 72.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.853 -1.067 . . . . 3.9100000000000001 111.258 -177.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.839 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 7.5 mmm -61.91 -59.83 4.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.212 -0.449 . . . . 1.0800000000000001 111.683 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -64.01 -36.32 83.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.429 -0.35 . . . . 0.25 110.78 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . 0.453 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 52.1 m -66.9 -39.21 87.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.416 -0.356 . . . . 0.40000000000000002 111.127 177.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . 0.547 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 55.4 t80 -60.31 -43.16 96.6 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.801 -0.444 . . . . 3.1299999999999999 109.801 175.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.54 HD13 ' HB2' ' A' ' 5' ' ' ASN . 5.7 tt -60.34 -50.27 74.29 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.745 -0.835 . . . . 0.94999999999999996 108.745 174.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . 0.453 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 3.8 m-80 -48.98 -58.31 5.1 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.932 -0.576 . . . . 0.46000000000000002 112.443 178.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -80.23 -45.03 18.7 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 0.58999999999999997 112.054 -172.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . 0.547 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 8.2 m80 -91.97 -50.55 5.65 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.361 0.874 . . . . 1.45 113.361 -171.155 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.539 HD21 ' NH2' ' A' ' 99' ' ' ARG . 58.8 mt -91.75 -34.96 14.41 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.607 0.966 . . . . 1.2 113.607 -165.319 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.627 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 31.7 tt0 -51.38 -49.84 79.75 Favored Pre-proline 0 C--N 1.324 -0.526 0 O-C-N 123.313 0.383 . . . . 0.75 111.657 -174.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 52.8 Cg_exo -52.87 -51.31 11.39 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 121.772 1.648 . . . . 0.56000000000000005 111.624 175.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -54.5 -54.22 43.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.45 -0.795 . . . . 1.2 110.544 178.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.575 HD12 ' HA ' ' A' ' 139' ' ' GLU . 13.6 mt -42.84 -51.84 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.406 -0.815 . . . . 0.32000000000000001 111.961 175.262 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.627 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 14.8 mm-40 -67.07 -30.01 69.94 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.934 -0.576 . . . . 0.56999999999999995 111.747 -176.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.0 mm-40 -68.28 -22.28 64.75 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.498 0.666 . . . . 0.78000000000000003 110.7 175.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.642 ' N ' HD22 ' A' ' 145' ' ' ASN . 0.7 OUTLIER -101.72 3.84 40.03 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.28 -0.873 . . . . 0.93000000000000005 108.974 -174.767 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 125.48 -34.02 3.45 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.696 -1.138 . . . . 0.56000000000000005 113.135 173.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 111.7 162.92 17.18 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 111.1 -0.8 . . . . 0.48999999999999999 111.1 -174.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.659 ' HB3' HG22 ' A' ' 46' ' ' VAL . 39.9 m95 -58.21 -33.59 69.48 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.124 0.787 . . . . 3.5699999999999998 113.124 -172.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.515 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 29.8 m-20 -56.56 -42.87 79.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.852 0.358 . . . . 1.96 110.082 176.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . 0.524 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 25.1 m -60.59 -36.48 78.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.733 -0.667 . . . . 0.67000000000000004 111.721 179.064 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . 0.685 ' CE2' ' HA ' ' A' ' 97' ' ' TRP . 2.2 m-85 -62.81 -39.68 95.04 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.184 0.516 . . . . 3.0 109.641 -177.714 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.621 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.4 m -75.5 -24.44 17.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.859 -0.61 . . . . 1.1499999999999999 110.053 176.114 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 12.8 mm-40 -60.88 -23.46 65.2 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 121.672 -0.642 . . . . 1.6699999999999999 110.478 173.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.6 mt -96.23 -56.04 2.76 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.886 -0.597 . . . . 1.3 110.101 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . 0.668 ' OH ' ' HB3' ' A' ' 151' ' ' PHE . 12.0 p90 -121.55 26.51 8.75 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.289 0.566 . . . . 4.2400000000000002 112.49 -173.161 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.812 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -61.48 161.4 26.68 Favored Glycine 0 C--N 1.305 -1.185 0 CA-C-N 115.165 -0.925 . . . . 1.1000000000000001 113.442 -178.003 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.581 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 26.0 t-20 . . . . . 0 C--N 1.31 -1.117 0 CA-C-N 114.011 -1.094 . . . . 1.29 111.299 179.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . 1.024 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.535 1.302 0 N-CA-C 114.984 0.754 . . . . 1.2 114.984 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 8.2 mpt_? -85.77 -33.83 21.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 117.635 0.717 . . . . 2.8799999999999999 111.636 175.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -95.15 -55.58 3.02 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.527 0.566 . . . . 1.3100000000000001 112.527 -167.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.671 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 2.9 mm? -65.89 -44.26 85.8 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.705 -0.48 . . . . 1.3300000000000001 109.705 -175.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 0.965 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -42.93 -44.5 4.61 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 122.474 1.13 . . . . 0.88 110.502 172.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -79.92 -51.16 9.45 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 113.467 -1.697 . . . . 1.03 111.204 -175.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 42.6 m-85 -66.61 -19.84 65.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.152 -0.476 . . . . 1.6699999999999999 110.913 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . 0.908 ' HA2' ' HZ ' ' A' ' 57' ' ' PHE . . . -82.23 -2.6 90.62 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 116.006 -0.543 . . . . 0.78000000000000003 113.033 -178.046 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 39.0 t70 -88.6 7.1 35.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.539 0.685 . . . . 1.8999999999999999 109.933 170.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 2.7 m . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 115.949 -0.568 . . . . 1.4399999999999999 110.158 178.182 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.413 ' O ' ' HB3' ' A' ' 6' ' ' ARG . 2.0 mp0 . . . . . 0 N--CA 1.457 -0.077 0 CA-C-O 120.693 0.282 . . . . 2.4199999999999999 111.091 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.2 p -63.96 -37.19 86.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.477 -0.329 . . . . 1.25 111.137 -179.791 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.622 ' HA ' HD13 ' A' ' 8' ' ' LEU . 23.9 p30 -64.65 -17.11 63.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.684 0.278 . . . . 1.78 110.869 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.519 ' NH1' ' HA ' ' A' ' 128' ' ' ALA . 9.9 tpp180 -60.22 -39.7 87.56 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.056 0.455 . . . . 1.3999999999999999 109.85 178.999 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -64.41 -42.54 96.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.625 -0.716 . . . . 0.68000000000000005 110.423 179.579 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.622 HD13 ' HA ' ' A' ' 5' ' ' ASN . 8.9 mp -54.36 -39.56 67.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.812 -0.631 . . . . 1.1599999999999999 110.401 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.422 HG13 ' HE2' ' A' ' 130' ' ' MET . 91.6 t -73.37 -64.8 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.927 -0.579 . . . . 0.27000000000000002 110.086 178.98 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.418 HG21 ' OE2' ' A' ' 31' ' ' GLU . 52.4 t -44.8 -66.77 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.254 -0.884 . . . . 0.33000000000000002 112.178 -179.969 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -43.32 -33.58 1.03 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.58999999999999997 112.137 -179.226 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.44 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.2 t80 -77.33 -46.68 22.15 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.107 -0.237 . . . . 1.6100000000000001 111.221 -179.556 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.654 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 10.0 mp -60.45 -37.51 81.2 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.948 0.404 . . . . 0.34000000000000002 110.525 179.536 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.46 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 38.3 t -68.13 -42.51 80.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.873 -0.603 . . . . 1.05 110.195 179.635 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -68.9 -24.28 64.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.713 -0.676 . . . . 1.22 110.442 179.596 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.541 ' HG3' HG21 ' A' ' 112' ' ' VAL . 1.9 tppt? -85.34 -16.52 39.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.942 -0.572 . . . . 1.4099999999999999 110.775 -179.761 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 mp -90.04 -13.92 34.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.072 -0.513 . . . . 1.3500000000000001 110.116 179.263 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 72.6 m -75.27 -35.88 61.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.788 -0.642 . . . . 0.93999999999999995 110.728 179.702 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -70.55 -4.84 25.04 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.318 -0.401 . . . . 1.3700000000000001 110.473 179.769 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.462 ' HG3' HG13 ' A' ' 112' ' ' VAL . 29.7 mmmt -109.51 -26.04 10.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.849 -0.614 . . . . 2.2000000000000002 110.775 -179.845 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.03 4.29 44.88 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.841 -0.695 . . . . 0.53000000000000003 111.98 -179.402 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -102.1 160.9 14.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.854 0.359 . . . . 0.76000000000000001 110.855 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.1 t -110.79 138.73 46.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.063 -0.517 . . . . 0.52000000000000002 110.573 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.46 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 11.6 t90 -68.01 -45.36 74.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.066 -0.516 . . . . 3.3599999999999999 111.085 -179.934 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.463 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 50.9 m -56.96 -41.68 78.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 1.3700000000000001 111.834 -179.369 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -56.59 -24.02 44.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.298 -0.41 . . . . 1.1100000000000001 112.044 -179.227 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.402 ' CG ' ' HB3' ' A' ' 120' ' ' GLN . 29.1 m-85 -126.7 16.0 7.52 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.878 0.325 . . . . 1.28 111.878 -179.08 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.539 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 83.6 p -99.9 -179.99 4.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.12 0.486 . . . . 1.8100000000000001 111.413 -179.792 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.465 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 9.7 t70 -166.07 -15.34 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.394 -0.821 . . . . 2.3100000000000001 109.868 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.701 HG23 ' H ' ' A' ' 31' ' ' GLU . 0.6 OUTLIER -58.58 -75.99 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.319 -0.855 . . . . 0.92000000000000004 111.809 -179.833 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.701 ' H ' HG23 ' A' ' 30' ' ' VAL . 42.8 mt-10 -87.5 -3.43 59.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.927 0.394 . . . . 2.7400000000000002 110.682 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.465 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 38.7 tt0 . . . . . 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 1.45 111.367 -179.627 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.607 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.95 0.405 . . . . 1.1200000000000001 110.491 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.607 ' H ' HG23 ' A' ' 41' ' ' THR . 12.2 pt-20 -124.07 -19.6 5.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.423 0.63 . . . . 2.02 109.377 179.084 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.739 ' HA ' HG22 ' A' ' 46' ' ' VAL . 27.1 m -72.77 -23.34 60.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.918 -1.037 . . . . 1.25 112.409 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -52.28 -36.36 52.59 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.094 0.405 . . . . 1.9099999999999999 112.094 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.452 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -91.81 -36.17 13.68 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.172 0.434 . . . . 0.52000000000000002 112.172 -179.024 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.739 HG22 ' HA ' ' A' ' 43' ' ' SER . 1.5 m -75.27 -28.12 20.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 111.876 0.324 . . . . 1.4099999999999999 111.876 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.6 ptmt -77.94 -34.21 51.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.887 0.375 . . . . 0.67000000000000004 110.121 -179.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.507 HE21 ' ND2' ' A' ' 157' ' ' ASN . 11.0 mm100 -68.61 -36.32 78.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.861 -0.609 . . . . 0.98999999999999999 109.423 178.745 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.445 ' HB2' HG23 ' A' ' 152' ' ' VAL . . . -77.59 -31.7 53.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.532 -0.758 . . . . 0.41999999999999998 109.47 178.544 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.566 HD21 ' CD2' ' A' ' 104' ' ' PHE . 28.9 tp -67.41 -31.65 72.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.972 -1.013 . . . . 1.3300000000000001 110.082 179.39 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -70.06 -40.45 75.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.263 -0.881 . . . . 2.1699999999999999 110.543 179.6 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.9 -45.97 69.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.927 -0.579 . . . . 1.1000000000000001 110.707 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.99 -36.54 83.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 0.53000000000000003 110.925 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.442 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -72.0 -37.88 60.14 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.811 -0.709 . . . . 0.69999999999999996 112.395 -179.985 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -55.35 -43.81 75.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.69 0.281 . . . . 1.04 111.386 -179.798 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -72.65 -16.68 61.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.335 -0.393 . . . . 2.29 111.49 -179.602 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -90.33 -31.46 16.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.578 -0.283 . . . . 2.29 111.26 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.442 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 49.2 mt-10 -63.84 -60.79 2.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.428 -0.351 . . . . 1.3 111.549 -179.523 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.469 HD12 ' N ' ' A' ' 60' ' ' ARG . 3.8 pp -54.97 -20.42 9.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.055 -0.521 . . . . 1.54 111.758 -179.347 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.469 ' N ' HD12 ' A' ' 59' ' ' LEU . 23.4 ttm180 -66.66 -38.5 86.97 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.2 0.445 . . . . 2.5800000000000001 112.2 -178.818 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -129.63 15.15 5.97 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.133 -0.227 . . . . 5.3200000000000003 111.449 -179.389 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.408 ' HA ' ' HB3' ' A' ' 65' ' ' PHE . 29.3 ttm180 -50.49 -47.0 57.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.501 -0.318 . . . . 4.4800000000000004 111.642 -179.685 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -32.33 54.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.171 -0.468 . . . . 4.7199999999999998 111.61 -179.2 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.421 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -91.22 -26.51 18.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.909 0.385 . . . . 1.1699999999999999 111.083 179.903 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.534 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -58.31 -39.25 78.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.944 -0.571 . . . . 2.8100000000000001 111.635 -179.33 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 69.6 m -76.5 -25.7 54.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.798 0.332 . . . . 2.1899999999999999 111.16 -179.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -93.7 -12.33 29.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.155 -0.475 . . . . 2.7200000000000002 111.045 -179.463 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.433 ' HG ' HE21 ' A' ' 71' ' ' GLN . 2.2 mp -80.91 -9.04 59.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 1.5600000000000001 111.143 -179.491 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.433 HG22 ' OE1' ' A' ' 113' ' ' GLU . 46.0 p -59.8 -31.03 69.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.69999999999999996 110.874 179.765 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -77.01 -36.88 55.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.962 -0.563 . . . . 1.3400000000000001 110.74 179.842 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.433 HE21 ' HG ' ' A' ' 68' ' ' LEU . 17.2 mt-30 -74.53 -23.62 58.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 1.4199999999999999 110.534 179.78 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.457 HD11 ' HZ ' ' A' ' 106' ' ' PHE . 44.7 mt -92.87 -18.22 23.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.811 -0.632 . . . . 1.3700000000000001 110.989 -179.903 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 m80 55.69 49.46 16.3 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 110.117 -0.327 . . . . 2.7200000000000002 110.117 -179.081 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.535 HG13 ' HB3' ' A' ' 113' ' ' GLU . 37.8 mm -49.56 93.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.991 -0.549 . . . . 0.91000000000000003 110.968 -179.755 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.556 ' O ' ' HB2' ' A' ' 79' ' ' ALA . 0.4 OUTLIER -130.94 164.6 40.96 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 115.478 -0.783 . . . . 0.51000000000000001 110.028 -179.368 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.515 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 12.4 Cg_endo -55.62 142.07 82.58 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.191 1.928 . . . . 0.46999999999999997 113.61 -179.234 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.702 ' H ' HD11 ' A' ' 122' ' ' LEU . . . 63.92 -77.56 0.05 OUTLIER Glycine 0 CA--C 1.52 0.401 0 CA-C-N 115.464 -0.789 . . . . 0.40000000000000002 114.828 178.17 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.469 HG22 ' NE2' ' A' ' 81' ' ' GLN . 58.9 p -55.05 -4.83 0.08 Allowed 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 113.652 0.982 . . . . 0.56000000000000005 113.652 -177.931 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.556 ' HB2' ' O ' ' A' ' 75' ' ' THR . . . -60.11 -24.8 64.95 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 121.483 0.659 . . . . 0.34000000000000002 109.233 178.447 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -69.1 -32.83 72.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.83 -1.077 . . . . 4.1299999999999999 110.091 179.242 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.469 ' NE2' HG22 ' A' ' 78' ' ' THR . 46.9 mt-30 -72.48 -25.47 61.44 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.269 0.557 . . . . 1.03 109.623 178.532 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.3 m -75.73 -40.44 55.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.442 -0.799 . . . . 0.47999999999999998 108.9 178.548 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -74.89 -14.59 60.68 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.921 -1.036 . . . . 1.1799999999999999 109.044 178.505 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.609 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.4 tt0 -67.77 -42.3 81.92 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.28 -0.873 . . . . 0.80000000000000004 110.39 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -60.36 -25.62 65.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.034 -0.53 . . . . 1.6200000000000001 110.618 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.408 HG21 ' CE2' ' A' ' 106' ' ' PHE . 41.4 t -87.31 -50.09 14.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.833 -0.621 . . . . 1.3 111.401 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.609 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.2 p -63.69 -26.85 41.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.444 -0.344 . . . . 0.84999999999999998 111.107 -179.719 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -67.14 -39.14 86.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.987 0.422 . . . . 0.91000000000000003 110.535 179.632 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.699 ' HA ' ' HD2' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -89.93 -4.18 57.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.884 -0.598 . . . . 2.8700000000000001 110.532 179.571 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.723 HD12 HH11 ' A' ' 99' ' ' ARG . 3.7 tp -93.59 9.21 37.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.736 -0.666 . . . . 1.28 111.291 -179.295 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.561 ' HA ' HG22 ' A' ' 95' ' ' VAL . 2.8 p90 -144.44 -28.66 0.49 Allowed 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.692 -0.403 . . . . 2.2999999999999998 111.937 -179.992 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.699 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -77.8 -22.88 49.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.73 0.3 . . . . 5.0599999999999996 110.971 -179.514 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.428 ' N ' ' HD3' ' A' ' 92' ' ' ARG . 19.9 t70 -88.92 2.49 53.72 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 3.1200000000000001 110.62 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 113.66 109.91 2.91 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.855 -0.688 . . . . 2.3100000000000001 112.389 -179.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.561 HG22 ' HA ' ' A' ' 91' ' ' PHE . 42.2 t -79.16 90.22 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.862 0.363 . . . . 1.0600000000000001 111.01 179.99 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' ASN . . . . . 0.635 ' N ' HD22 ' A' ' 96' ' ' ASN . 0.7 OUTLIER -89.48 178.34 6.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.048 -0.524 . . . . 2.1200000000000001 110.348 179.653 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 22.1 m-90 -60.55 -60.57 3.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.032 0.444 . . . . 3.3399999999999999 110.146 179.121 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.618 ' O ' HG22 ' A' ' 101' ' ' VAL . . . -64.45 -26.19 70.58 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.618 -0.719 . . . . 0.68999999999999995 111.996 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.723 HH11 HD12 ' A' ' 90' ' ' LEU . 13.5 tpp180 -56.06 -36.04 67.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.21 0.528 . . . . 4.2400000000000002 110.162 179.376 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.569 HG23 HD23 ' A' ' 138' ' ' LEU . 37.9 mt -71.99 -37.67 61.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.445 -0.798 . . . . 0.44 111.198 -179.775 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 98' ' ' GLY . 1.0 OUTLIER -63.23 -29.8 48.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.03 0.443 . . . . 1.3500000000000001 109.958 179.616 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.19 -28.98 67.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.705 -0.68 . . . . 0.44 109.509 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.503 ' HB2' HD23 ' A' ' 90' ' ' LEU . 86.3 t80 -72.06 -22.27 61.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.97 -1.014 . . . . 1.49 110.207 179.455 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.566 ' CD2' HD21 ' A' ' 50' ' ' LEU . 72.2 m-85 -90.86 -46.02 8.45 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.773 -0.649 . . . . 3.29 111.201 179.765 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.44 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 19.7 p -62.01 -40.65 96.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.937 -0.574 . . . . 1.1899999999999999 110.665 -179.954 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 106' ' ' PHE . . . . . 0.457 ' HZ ' HD11 ' A' ' 72' ' ' LEU . 15.9 t80 -80.25 -41.91 24.19 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.18 -0.463 . . . . 2.8900000000000001 110.591 179.864 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.91 -43.76 98.95 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.451 -0.88 . . . . 0.29999999999999999 111.12 178.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 108' ' ' GLY . . . . . 0.654 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -70.67 -28.65 70.57 Favored Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 110.591 -1.004 . . . . 0.23000000000000001 110.591 178.449 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.534 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -70.55 -30.84 67.67 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.256 -0.646 . . . . 0.31 109.256 178.338 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.506 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -65.3 -33.74 76.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.446 -0.797 . . . . 1.1200000000000001 108.896 178.851 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.504 ' SG ' HG13 ' A' ' 123' ' ' VAL . 3.2 t -68.12 -38.49 82.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.184 -0.916 . . . . 0.26000000000000001 109.955 178.906 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 112' ' ' VAL . . . . . 0.541 HG21 ' HG3' ' A' ' 16' ' ' LYS . 74.7 t -70.1 -39.23 76.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.725 -0.67 . . . . 0.34999999999999998 110.534 179.339 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.535 ' HB3' HG13 ' A' ' 74' ' ' ILE . 31.0 mt-10 -67.65 -21.15 65.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.038 -0.528 . . . . 2.5099999999999998 109.948 179.454 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . 0.469 ' HB3' ' HB2' ' A' ' 122' ' ' LEU . 74.9 m -77.23 -50.16 13.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.677 -0.692 . . . . 0.28000000000000003 109.867 179.07 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.536 HG23 ' HG3' ' A' ' 120' ' ' GLN . 3.4 p -66.65 -21.82 29.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.059 -0.519 . . . . 1.23 109.983 179.001 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -63.63 -37.85 88.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.64 -0.709 . . . . 0.59999999999999998 110.492 179.477 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -93.69 22.29 5.64 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.992 -0.549 . . . . 1.6200000000000001 110.716 179.898 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 67.77 22.32 8.9 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.205 -0.452 . . . . 1.8799999999999999 110.936 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 119' ' ' MET . . . . . 0.495 ' SD ' ' HD3' ' A' ' 76' ' ' PRO . 10.4 mtm -114.77 78.01 1.12 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.251 -0.431 . . . . 0.31 110.506 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.536 ' HG3' HG23 ' A' ' 115' ' ' VAL . 13.9 mp0 -84.59 -3.5 58.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.474 -0.33 . . . . 1.1499999999999999 111.668 -179.219 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.691 HG23 HD22 ' A' ' 122' ' ' LEU . 25.4 m -72.61 -5.91 7.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.855 0.36 . . . . 0.46000000000000002 110.914 179.87 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.702 HD11 ' H ' ' A' ' 77' ' ' GLY . 4.1 mm? -93.09 -16.87 24.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.043 -0.526 . . . . 0.26000000000000001 110.063 179.123 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.504 HG13 ' SG ' ' A' ' 111' ' ' CYS . 94.3 t -52.72 -59.08 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.786 -0.643 . . . . 0.25 111.074 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 124' ' ' SER . . . . . 0.539 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 37.5 t -65.83 -36.76 84.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.032 -0.531 . . . . 1.3500000000000001 111.449 -179.692 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . 0.619 ' HD2' HD13 ' A' ' 122' ' ' LEU . 94.4 mtt180 -60.74 -67.12 0.43 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.507 -0.315 . . . . 2.6699999999999999 111.248 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 126' ' ' ILE . . . . . 0.506 HD13 ' HB3' ' A' ' 110' ' ' LEU . 74.6 mt -44.82 -42.68 2.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.044 -0.525 . . . . 0.23000000000000001 111.489 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.587 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.62 -42.52 78.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.416 -0.357 . . . . 0.28999999999999998 111.057 179.855 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.519 ' HA ' ' NH1' ' A' ' 6' ' ' ARG . . . -69.13 -41.47 77.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.031 -0.531 . . . . 0.28000000000000003 111.376 -179.963 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -64.31 -39.36 93.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.325 -0.398 . . . . 3.9100000000000001 111.32 -179.778 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.422 ' HE2' HG13 ' A' ' 9' ' ' VAL . 89.2 mtp -65.16 -52.83 52.65 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.19 -0.459 . . . . 1.0800000000000001 111.083 -179.574 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -57.8 -53.91 52.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.277 -0.419 . . . . 0.25 110.749 179.788 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.8 m -54.22 -49.73 68.76 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.052 -0.522 . . . . 0.40000000000000002 111.066 179.869 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -57.03 -30.78 64.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.151 0.5 . . . . 3.1299999999999999 110.052 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.619 ' O ' HD23 ' A' ' 134' ' ' LEU . 3.6 tt -81.28 -23.2 38.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.55 -0.75 . . . . 0.94999999999999996 110.119 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -83.06 -6.91 59.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 0.46000000000000002 112.06 -179.525 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -126.99 -30.47 2.71 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.126 0.787 . . . . 0.58999999999999997 113.126 -178.148 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 8.3 m80 -107.54 -52.36 2.77 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.29 0.848 . . . . 1.45 113.29 -178.124 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.569 HD23 HG23 ' A' ' 100' ' ' ILE . 10.1 mp -80.84 -37.24 30.33 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.858 1.059 . . . . 1.2 113.858 -177.102 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.453 ' N ' ' HD2' ' A' ' 140' ' ' PRO . 34.8 tt0 -48.73 -53.84 32.88 Favored Pre-proline 0 N--CA 1.468 0.453 0 N-CA-C 112.407 0.521 . . . . 0.75 112.407 -178.073 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . 0.463 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 37.2 Cg_endo -65.6 -28.58 52.81 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.733 1.622 . . . . 0.56000000000000005 112.272 -179.623 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 141' ' ' TRP . . . . . 0.444 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 1.2 t-105 -78.57 -30.01 46.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 1.2 111.155 -179.612 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 142' ' ' ILE . . . . . 0.681 HG22 ' HA2' ' A' ' 147' ' ' GLY . 60.5 mt -69.83 -40.22 78.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.969 -0.559 . . . . 0.32000000000000001 110.656 -179.706 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 79.0 mm-40 -63.08 -28.68 70.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.519 . . . . 0.56999999999999995 110.114 179.322 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 16.5 mm-40 -69.62 -23.8 63.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.847 -0.615 . . . . 0.78000000000000003 110.235 179.301 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 145' ' ' ASN . . . . . 0.566 ' N ' HD22 ' A' ' 145' ' ' ASN . 0.8 OUTLIER -97.51 -1.37 44.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.712 -0.676 . . . . 0.93000000000000005 110.718 -179.994 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.14 -35.91 3.61 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.869 -0.682 . . . . 0.56000000000000005 112.812 179.758 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . 0.681 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 117.15 167.31 14.39 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.806 -0.711 . . . . 0.48999999999999999 112.155 -179.741 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 148' ' ' TRP . . . . . 0.562 ' NE1' HD13 ' A' ' 142' ' ' ILE . 10.7 m-90 -57.76 -38.24 75.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.061 0.458 . . . . 3.5699999999999998 110.176 179.459 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.445 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 32.5 t70 -60.34 -27.38 67.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.634 -0.712 . . . . 1.96 110.449 179.867 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 25.2 m -83.37 -25.38 31.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.273 0.558 . . . . 0.67000000000000004 109.912 178.996 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -68.48 -35.2 77.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.481 -0.781 . . . . 3.0 110.383 179.547 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 152' ' ' VAL . . . . . 0.452 HG21 ' HB1' ' A' ' 45' ' ' ALA . 12.2 p -78.79 -2.17 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.436 0.636 . . . . 1.1499999999999999 110.114 179.265 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 15.8 mm-40 -91.69 -18.02 24.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.809 -0.632 . . . . 1.6699999999999999 109.7 178.657 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 22.7 mt -106.58 -52.88 2.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.488 -0.778 . . . . 1.3 110.393 179.714 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -109.0 27.82 9.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.577 -0.738 . . . . 4.2400000000000002 110.943 -179.824 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 156' ' ' GLY . . . . . 0.439 ' HA2' HG23 ' A' ' 152' ' ' VAL . . . -46.78 152.46 1.32 Allowed Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.909 -0.587 . . . . 1.1000000000000001 113.683 -179.324 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 157' ' ' ASN . . . . . 0.507 ' ND2' HE21 ' A' ' 48' ' ' GLN . 21.5 t-20 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 115.624 -0.288 . . . . 1.29 110.661 179.719 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1005 ' ' GLY . . . . . 0.684 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . . . . . . 0 CA--C 1.521 0.463 0 N-CA-C 112.858 -0.097 . . . . 1.2 112.858 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -110.11 -40.61 4.67 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.835 0.35 . . . . 2.8799999999999999 111.188 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -56.95 -76.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.008 -0.542 . . . . 1.3100000000000001 112.22 -179.197 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1008 ' ' LEU . . . . . 0.546 ' H ' HD22 ' B' 1008 ' ' LEU . 3.3 mm? -50.99 -35.2 32.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 1.3300000000000001 111.846 -178.875 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B 1009 ' ' ALA . . . . . 0.624 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -62.8 -38.87 92.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.121 0.486 . . . . 0.88 110.977 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B 1010 ' ' ALA . . . . . . . . . . . . . . . -79.95 -52.64 7.59 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.577 -0.738 . . . . 1.03 111.704 -179.306 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -60.31 -25.42 65.76 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.805 0.336 . . . . 1.6699999999999999 110.763 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.88 9.15 12.01 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 121.007 -0.616 . . . . 0.78000000000000003 112.787 -179.829 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 20.7 t70 -105.16 -5.15 20.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.988 0.423 . . . . 1.8999999999999999 110.405 179.748 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 5.1 m . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 115.862 -0.608 . . . . 1.4399999999999999 111.239 -179.585 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.9 tpt . . . . . 0 N--CA 1.481 1.098 0 CA-C-O 120.714 0.293 . . . . 6.21 110.857 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.6 m -132.67 -59.81 0.89 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.515 -0.311 . . . . 1.8700000000000001 110.787 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 37' ' ' ALA . 24.1 mp0 -70.19 1.1 5.14 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.137 0.421 . . . . 2.4199999999999999 112.137 -177.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.2 m -65.17 -18.05 64.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.833 0.349 . . . . 1.25 110.815 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.597 ' HB2' HD13 ' A' ' 134' ' ' LEU . 4.9 p30 -59.0 -27.25 65.25 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.055 -0.521 . . . . 1.78 111.01 173.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.586 ' O ' HG23 ' A' ' 10' ' ' VAL . 8.7 tpp85 -58.93 -47.76 83.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.814 -0.63 . . . . 1.3999999999999999 110.278 177.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.566 ' OE1' ' HA2' ' A' ' 40' ' ' GLY . 44.9 mt-10 -54.46 -47.71 72.6 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 115.316 -0.857 . . . . 0.68000000000000005 110.867 -179.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.437 HD22 HG22 ' A' ' 46' ' ' VAL . 6.2 mt -57.77 -40.16 79.14 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.5 -1.227 . . . . 1.1599999999999999 109.814 -173.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 77.4 t -67.53 -59.68 3.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.552 -0.749 . . . . 0.27000000000000002 110.196 174.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 6' ' ' ARG . 63.4 t -53.6 -50.86 47.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.117 -0.947 . . . . 0.33000000000000002 112.633 -174.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.6 -37.21 70.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.872 0.367 . . . . 0.58999999999999997 110.876 -176.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.706 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 35.3 t80 -73.6 -47.18 42.31 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 116.297 -0.41 . . . . 1.6100000000000001 110.793 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.877 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.7 mp -59.13 -38.04 78.67 Favored 'General case' 0 C--O 1.228 -0.075 0 C-N-CA 120.249 -0.58 . . . . 0.34000000000000002 109.797 178.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.448 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 26.3 m -55.27 -50.42 69.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 1.05 110.853 175.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -64.62 -32.06 73.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.003 -0.544 . . . . 1.22 110.461 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.625 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 7.6 mmpt? -63.94 -43.99 94.21 Favored 'General case' 0 CA--C 1.505 -0.761 0 CA-C-N 115.974 -0.557 . . . . 1.4099999999999999 111.353 -178.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.657 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.4 OUTLIER -71.55 -30.2 65.61 Favored 'General case' 0 C--N 1.313 -0.983 0 C-N-CA 120.178 -0.609 . . . . 1.3500000000000001 110.079 178.633 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.6 t -60.81 -40.23 91.95 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.638 -0.71 . . . . 0.93999999999999995 111.24 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -78.91 0.3 27.9 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.959 0.409 . . . . 1.3700000000000001 112.014 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.652 ' HE2' HG11 ' A' ' 112' ' ' VAL . 19.0 mmmt -111.6 -27.08 8.71 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.899 0.857 . . . . 2.2000000000000002 109.123 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.79 20.29 11.87 Favored Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 114.097 -1.411 . . . . 0.53000000000000003 111.663 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -108.18 167.38 10.05 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.37 -0.604 . . . . 0.76000000000000001 109.37 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.42 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 3.9 t -110.42 144.42 39.24 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-O 121.084 0.468 . . . . 0.52000000000000002 110.359 176.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.448 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.8 OUTLIER -74.44 -48.36 28.0 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.53 -0.759 . . . . 3.3599999999999999 109.787 175.06 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.471 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 2.5 p -66.19 -31.46 72.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.035 -0.53 . . . . 1.3700000000000001 111.92 -173.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.42 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 89.9 mt-30 -61.71 -25.33 67.36 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.259 0.552 . . . . 1.1100000000000001 111.148 177.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -121.35 17.64 11.42 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.559 -0.746 . . . . 1.28 111.058 -176.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.567 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 54.1 p -100.24 -178.13 3.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.484 0.659 . . . . 1.8100000000000001 112.415 -171.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.615 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 6.7 t70 -171.97 -23.81 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.378 -1.283 . . . . 2.3100000000000001 109.069 -178.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.831 HG23 ' H ' ' A' ' 31' ' ' GLU . 7.1 m -47.17 -70.83 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-N 114.274 -1.33 . . . . 0.92000000000000004 112.643 -174.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.831 ' H ' HG23 ' A' ' 30' ' ' VAL . 8.7 pt-20 -100.6 1.16 40.5 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.53 0.681 . . . . 2.7400000000000002 109.245 175.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.615 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 31.1 tt0 -68.13 -53.88 22.12 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.814 -1.085 . . . . 1.45 110.894 -176.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.2 m-80 -101.17 -28.93 12.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.962 -0.563 . . . . 1.8700000000000001 111.286 -175.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.545 ' O ' ' HA ' ' A' ' 31' ' ' GLU . 15.0 ptp180 -125.39 149.07 48.5 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.683 -0.488 . . . . 3.3900000000000001 109.683 177.105 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.7 p -104.8 107.95 19.18 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.554 0.693 . . . . 2.25 111.28 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -89.7 -80.51 0.31 Allowed 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.066 -0.97 . . . . 3.3399999999999999 109.83 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 3' ' ' GLN . . . -102.66 157.32 33.95 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 115.715 -0.675 . . . . 1.9199999999999999 110.911 177.344 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.779 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 50.2 Cg_exo -58.01 -175.82 0.07 OUTLIER 'Trans proline' 0 CA--C 1.533 0.454 0 C-N-CA 123.401 2.734 . . . . 1.8700000000000001 113.003 172.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -80.11 -10.51 59.77 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.412 0.625 . . . . 4.6399999999999997 110.485 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.566 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 166.53 63.24 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.646 -0.706 . . . . 2.1499999999999999 111.748 178.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.81 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.8 OUTLIER -67.78 -75.5 0.1 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 120.724 -0.39 . . . . 1.1200000000000001 110.488 -175.16 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.81 ' H ' HG23 ' A' ' 41' ' ' THR . 15.2 pt-20 -93.68 -31.94 14.25 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-O 122.343 1.068 . . . . 2.02 108.935 170.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.952 ' HA ' HG13 ' A' ' 46' ' ' VAL . 66.6 m -59.17 -25.91 64.33 Favored 'General case' 0 C--O 1.209 -1.027 0 CA-C-N 113.315 -1.766 . . . . 1.25 113.496 -170.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -43.96 -38.89 3.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 118.131 0.423 . . . . 1.9099999999999999 111.56 -177.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.409 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -86.06 -42.35 14.02 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 111.567 0.21 . . . . 0.52000000000000002 111.567 174.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.952 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.6 m -68.33 -41.92 83.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 C-N-CA 120.908 -0.317 . . . . 1.4099999999999999 111.796 -175.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.795 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.0 ptpt -68.4 -36.26 78.85 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 109.154 -0.684 . . . . 0.67000000000000004 109.154 178.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.521 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 5.1 mm100 -61.16 -36.52 80.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.587 -0.733 . . . . 0.98999999999999999 111.405 174.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.625 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -75.7 -40.66 55.41 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.673 0.749 . . . . 0.41999999999999998 110.177 175.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.559 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -56.65 -40.71 75.94 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.722 -1.126 . . . . 1.3300000000000001 112.113 -178.92 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.544 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 7.5 ptp180 -75.44 -29.89 59.84 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-O 121.774 0.797 . . . . 2.1699999999999999 109.617 -169.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 32.9 mm-40 -72.51 -48.3 41.63 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 114.283 -1.326 . . . . 1.1000000000000001 109.852 179.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.57 -36.99 85.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.557 -0.747 . . . . 0.53000000000000003 110.355 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.585 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -61.89 -42.36 99.73 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.912 -0.585 . . . . 0.69999999999999996 111.782 176.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -58.64 -42.98 89.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.005 0.431 . . . . 1.04 110.517 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -57.41 -28.26 63.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.394 -0.821 . . . . 2.29 111.239 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.496 ' CZ ' HD12 ' B' 1008 ' ' LEU . 17.2 t80 -82.2 -39.4 23.18 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.221 -0.445 . . . . 2.29 110.983 178.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.705 ' HA ' ' CE2' ' A' ' 61' ' ' TYR . 40.2 mt-10 -60.52 -63.69 1.21 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.138 -0.483 . . . . 1.3 112.21 -168.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.636 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -49.64 -37.46 28.35 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 123.673 0.608 . . . . 1.54 112.342 -178.399 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.636 ' H ' HD12 ' A' ' 59' ' ' LEU . 63.6 mtt180 -63.6 -44.54 93.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.172 -0.467 . . . . 2.5800000000000001 111.728 -177.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.705 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 5.5 p90 -90.95 -7.81 51.03 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 120.654 -0.418 . . . . 5.3200000000000003 111.506 -179.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -58.28 -26.0 62.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 4.4800000000000004 111.385 -174.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -55.87 -46.26 78.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.046 -0.525 . . . . 4.7199999999999998 110.937 174.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.701 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.85 -32.7 15.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.409 -0.36 . . . . 1.1699999999999999 111.498 -178.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.697 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 47.5 t80 -42.91 -46.92 5.54 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.735 1.013 . . . . 2.8100000000000001 113.735 -171.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 4.2 p -68.13 -27.53 66.52 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.92 0.391 . . . . 2.1899999999999999 111.608 -175.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -90.42 -29.21 18.14 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.023 -0.535 . . . . 2.7200000000000002 111.552 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.701 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 65.1 mt -66.48 -17.77 64.99 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.894 0.702 . . . . 1.5600000000000001 112.894 -171.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.641 HG22 HG13 ' A' ' 74' ' ' ILE . 8.6 p -61.24 -24.77 66.6 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.429 0.633 . . . . 0.69999999999999996 110.694 -176.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 50.0 m -74.95 -29.71 61.01 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.847 -1.069 . . . . 1.3400000000000001 110.501 176.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.815 HE22 ' HB2' ' B' 1003 ' ' CYS . 12.6 mt-30 -82.0 -49.47 10.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.475 -0.784 . . . . 1.4199999999999999 110.504 -177.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.699 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.7 mp -66.17 -28.77 69.03 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.086 -0.709 . . . . 1.3700000000000001 109.086 176.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 67.9 t60 64.45 55.26 1.39 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 122.244 1.021 . . . . 2.7200000000000002 108.253 -176.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.641 HG13 HG22 ' A' ' 69' ' ' THR . 15.5 mm -57.42 112.04 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 113.628 -1.624 . . . . 0.91000000000000003 110.666 -178.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.781 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.5 -167.45 0.16 Allowed Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 107.424 -1.324 . . . . 0.51000000000000001 107.424 -169.12 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.781 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.0 Cg_exo -29.03 165.92 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.303 0 C-N-CA 124.636 3.558 . . . . 0.46999999999999997 115.037 162.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -34.61 -24.63 0.01 OUTLIER Glycine 0 N--CA 1.474 1.208 0 N-CA-C 117.221 1.648 . . . . 0.40000000000000002 117.221 -171.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 76' ' ' PRO . 40.1 p -69.1 3.37 2.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 117.956 0.878 . . . . 0.56000000000000005 112.096 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.11 -14.15 62.2 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.274 0.559 . . . . 0.34000000000000002 109.961 173.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -78.12 -15.82 58.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.954 -0.567 . . . . 4.1299999999999999 109.543 176.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.497 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 36.5 mt-30 -87.87 -22.62 24.32 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.801 0.81 . . . . 1.03 109.672 173.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.528 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 5.8 m -72.35 -48.71 39.67 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 114.617 -1.174 . . . . 0.47999999999999998 109.293 170.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.5 ' O ' HG13 ' A' ' 86' ' ' VAL . 84.8 t80 -70.69 -15.59 62.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.021 -0.991 . . . . 1.1799999999999999 110.047 173.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.662 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.1 tt0 -64.7 -49.07 72.35 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.167 0.508 . . . . 0.80000000000000004 110.276 175.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.416 ' H ' ' HG3' ' A' ' 85' ' ' GLN . 64.1 mt-30 -43.07 -44.8 5.02 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 114.525 -1.216 . . . . 1.6200000000000001 111.318 178.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.966 ' HA ' ' HA2' ' B' 1005 ' ' GLY . 0.9 OUTLIER -86.15 -44.53 16.74 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.335 0 CA-C-N 113.835 -1.53 . . . . 1.3 111.829 -172.645 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.662 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.8 p -62.23 -23.53 32.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.98 0.895 . . . . 0.84999999999999998 109.876 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.73 -48.52 74.31 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.357 -1.292 . . . . 0.91000000000000003 110.917 176.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.714 ' HB3' ' HB2' ' B' 1009 ' ' ALA . 5.6 mm-40 -69.15 -43.56 74.06 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-O 122.443 1.116 . . . . 2.8700000000000001 108.815 178.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.597 ' HG ' ' NH1' ' A' ' 99' ' ' ARG . 8.4 tp -54.86 -24.98 25.71 Favored 'General case' 0 N--CA 1.423 -1.792 0 CA-C-N 112.312 -2.222 . . . . 1.28 111.518 -173.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.506 ' O ' HG23 ' A' ' 95' ' ' VAL . 76.1 t80 -100.04 -35.67 9.62 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.637 0.732 . . . . 2.2999999999999998 110.935 -173.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.544 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 7.5 ptm180 -77.82 -35.26 51.5 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.502 -0.772 . . . . 5.0599999999999996 111.42 -172.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -93.22 20.64 6.74 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.411 -0.813 . . . . 3.1200000000000001 112.753 -169.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.584 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 128.02 68.59 0.14 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 117.167 -2.444 . . . . 2.3100000000000001 115.935 174.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.569 ' HA ' ' HE ' ' A' ' 99' ' ' ARG . 67.8 t -73.31 98.43 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 118.649 1.225 . . . . 1.0600000000000001 111.611 177.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.409 ' ND2' ' N ' ' A' ' 96' ' ' ASN . 1.0 OUTLIER -112.45 -170.78 1.73 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.327 -1.306 . . . . 2.1200000000000001 108.996 179.582 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.754 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 22.5 m-90 -63.63 -63.54 1.14 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.9 0.381 . . . . 3.3399999999999999 110.666 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.427 ' O ' HG22 ' A' ' 101' ' ' VAL . . . -67.11 -26.66 73.35 Favored Glycine 0 C--O 1.225 -0.411 0 CA-C-N 115.933 -0.576 . . . . 0.68999999999999995 112.723 -177.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.598 ' HD2' ' O ' ' A' ' 99' ' ' ARG . 1.7 tmm_? -58.23 -40.16 80.95 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.936 0.398 . . . . 4.2400000000000002 110.268 178.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 52.6 mt -67.8 -28.18 40.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 116.522 -0.308 . . . . 0.44 111.656 -175.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.527 HG22 HD13 ' B' 1015 ' ' ILE . 0.8 OUTLIER -64.03 -25.88 39.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.308 0.575 . . . . 1.3500000000000001 110.079 176.472 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.482 ' HA ' ' CD2' ' A' ' 57' ' ' PHE . . . -66.94 -39.79 87.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.735 0.779 . . . . 0.44 110.327 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.463 ' HB2' HH12 ' A' ' 99' ' ' ARG . 28.0 t80 -64.0 -46.17 85.74 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.366 -1.288 . . . . 1.49 110.914 -178.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.595 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.1 OUTLIER -80.36 -18.69 48.29 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 120.529 -0.468 . . . . 3.29 110.553 -178.283 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.706 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 35.3 t -75.17 -57.5 3.85 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.383 -0.371 . . . . 1.1899999999999999 110.59 178.369 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -68.3 -24.19 64.82 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 109.498 -0.556 . . . . 2.8900000000000001 109.498 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.469 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -67.12 -42.3 91.8 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.69 -0.767 . . . . 0.29999999999999999 111.467 172.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.877 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.82 -31.29 79.28 Favored Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.66 -0.781 . . . . 0.23000000000000001 111.396 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.697 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -75.2 -33.05 61.37 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.69 -0.255 . . . . 0.31 110.553 176.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -39.4 83.62 Favored 'General case' 0 CA--C 1.513 -0.463 0 N-CA-C 107.956 -1.127 . . . . 1.1200000000000001 107.956 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.771 ' SG ' HG22 ' A' ' 123' ' ' VAL . 29.9 t -49.57 -62.92 1.28 Allowed 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 113.368 -1.742 . . . . 0.26000000000000001 110.204 172.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.887 ' HA ' HG13 ' A' ' 115' ' ' VAL . 46.8 t -63.18 -34.54 67.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.384 -0.371 . . . . 0.34999999999999998 111.48 -176.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.62 ' HB3' HG21 ' A' ' 74' ' ' ILE . 36.7 mt-10 -55.91 -25.32 42.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.097 0.475 . . . . 2.5099999999999998 110.418 176.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.44 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 65.0 m -85.0 -41.46 15.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 108.485 -0.931 . . . . 0.28000000000000003 108.485 -178.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.887 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.4 m -69.14 -29.74 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.349 0 CA-C-N 114.734 -1.121 . . . . 1.23 109.422 -177.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -51.31 -51.03 58.01 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.205 -1.816 . . . . 0.59999999999999998 111.563 175.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -83.52 10.59 8.63 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.724 -0.671 . . . . 1.6200000000000001 109.743 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.613 ' HA ' ' NE2' ' A' ' 120' ' ' GLN . 36.0 mt-10 63.31 55.82 1.79 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 122.159 0.981 . . . . 1.8799999999999999 109.805 -176.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 24.6 mtm -134.96 37.36 3.04 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 113.848 -1.524 . . . . 0.31 107.553 179.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.702 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 4.9 mp0 -52.28 -7.36 0.06 Allowed 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 114.903 -1.044 . . . . 1.1499999999999999 113.353 -178.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.447 HG23 HD22 ' A' ' 122' ' ' LEU . 27.0 m -67.41 -22.41 28.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 121.464 -0.773 . . . . 0.46000000000000002 111.921 176.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.715 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.5 mm? -71.6 -24.77 61.95 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.014 0.435 . . . . 0.26000000000000001 109.928 178.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.771 HG22 ' SG ' ' A' ' 111' ' ' CYS . 42.3 t -44.92 -49.38 2.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 114.716 -1.129 . . . . 0.25 112.593 -177.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.567 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 8.9 t -78.22 -34.83 49.07 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.44 -0.504 . . . . 1.3500000000000001 110.58 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.715 ' HD2' HD13 ' A' ' 122' ' ' LEU . 66.5 mtt180 -62.85 -49.27 75.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.002 -0.545 . . . . 2.6699999999999999 110.418 -176.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.547 HD12 ' HA ' ' A' ' 111' ' ' CYS . 73.6 mt -57.82 -52.19 60.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.488 -0.778 . . . . 0.23000000000000001 110.767 178.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.748 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -54.07 -36.68 63.4 Favored 'General case' 0 C--O 1.233 0.234 0 O-C-N 123.291 0.37 . . . . 0.28999999999999998 111.339 -178.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.46 -56.13 23.54 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.357 0.599 . . . . 0.28000000000000003 111.054 177.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -72.57 -23.7 61.0 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.225 -0.898 . . . . 3.9100000000000001 111.627 -174.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.545 ' SD ' HG22 ' A' ' 126' ' ' ILE . 88.8 mtp -66.01 -58.72 4.87 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.1 0.476 . . . . 1.0800000000000001 110.343 174.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.96 -35.65 79.09 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.704 -0.68 . . . . 0.25 110.702 -178.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.6 m -63.47 -46.7 84.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.411 -0.359 . . . . 0.40000000000000002 110.95 176.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -56.69 -39.12 73.25 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.858 -0.423 . . . . 3.1299999999999999 109.858 177.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.949 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.9 tt -62.77 -50.98 68.9 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.985 -0.746 . . . . 0.94999999999999996 108.985 174.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -51.46 -49.54 61.54 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.673 0.62 . . . . 0.46000000000000002 112.673 -179.235 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -83.15 -51.29 7.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.041 0.448 . . . . 0.58999999999999997 112.103 -176.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -91.4 -50.46 5.79 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 113.121 0.786 . . . . 1.45 113.121 -170.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.949 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -80.61 -45.05 17.93 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.564 0.95 . . . . 1.2 113.564 -168.323 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.605 ' HA ' HD12 ' A' ' 142' ' ' ILE . 28.1 tt0 -47.47 -50.4 49.82 Favored Pre-proline 0 C--N 1.322 -0.612 0 O-C-N 123.686 0.616 . . . . 0.75 112.526 -175.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.576 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 51.8 Cg_exo -52.99 -50.26 14.69 Favored 'Trans proline' 0 C--N 1.358 1.079 0 C-N-CA 121.746 1.63 . . . . 0.56000000000000005 111.734 176.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -58.83 -48.16 82.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.587 -0.733 . . . . 1.2 110.513 178.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.605 HD12 ' HA ' ' A' ' 139' ' ' GLU . 43.9 mt -49.92 -50.96 17.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.058 -0.519 . . . . 0.32000000000000001 111.351 176.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.58 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 79.2 mm-40 -60.21 -31.45 70.17 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.559 -0.746 . . . . 0.56999999999999995 111.587 -179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.7 mm-40 -65.41 -20.71 66.49 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 121.519 0.676 . . . . 0.78000000000000003 110.685 177.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.414 ' HB3' ' CE2' ' A' ' 97' ' ' TRP . 18.1 m-80 -111.47 5.84 19.83 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.088 -0.96 . . . . 0.93000000000000005 110.371 -174.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.01 -47.08 1.06 Allowed Glycine 0 N--CA 1.441 -1.006 0 CA-C-N 115.318 -0.855 . . . . 0.56000000000000005 113.294 173.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.559 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 130.16 -172.39 20.24 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.48 -0.867 . . . . 0.48999999999999999 112.064 -177.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . . . . . . . . . 9.0 m-90 -76.08 -35.5 59.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.529 0.204 . . . . 3.5699999999999998 110.742 -177.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -59.1 -43.94 91.91 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.176 0.512 . . . . 1.96 109.702 175.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.593 ' O ' HD13 ' A' ' 154' ' ' LEU . 95.8 m -60.1 -34.48 73.54 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.29 -0.868 . . . . 0.67000000000000004 111.021 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.754 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 90.0 t80 -60.68 -41.44 95.09 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.482 -0.487 . . . . 3.0 110.212 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.512 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.5 m -76.03 -26.94 17.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 120.916 0.389 . . . . 1.1499999999999999 110.486 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' A' ' 150' ' ' THR . 7.8 mm-40 -56.0 -47.95 76.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.342 0.592 . . . . 1.6699999999999999 109.56 170.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.593 HD13 ' O ' ' A' ' 150' ' ' THR . 7.4 mp -78.25 -61.25 2.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.2 -0.909 . . . . 1.3 112.902 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -120.83 29.64 7.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.303 0.573 . . . . 4.2400000000000002 110.423 -168.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.625 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -58.92 166.19 7.89 Favored Glycine 0 CA--C 1.506 -0.473 0 CA-C-N 115.476 -0.784 . . . . 1.1000000000000001 114.115 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.501 ' ND2' HE21 ' A' ' 48' ' ' GLN . 26.9 t-20 -56.37 110.07 0.71 Allowed 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 113.835 -1.182 . . . . 1.29 111.038 -179.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.561 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 7.4 t30 -81.86 -16.56 50.33 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 116.31 -0.404 . . . . 2.9900000000000002 110.378 -174.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.01 -51.68 69.02 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.656 -0.498 . . . . 2.52 109.656 172.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -67.15 -32.51 73.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.631 -0.713 . . . . 2.8700000000000001 110.243 175.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.561 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -57.46 -52.05 66.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.709 -0.678 . . . . 3.2000000000000002 110.49 176.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 158' ' ' ASN . 42.4 mt-10 -67.92 -31.5 71.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.249 -0.432 . . . . 3.7200000000000002 110.732 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 36.2 t -58.1 -46.34 85.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.063 -0.517 . . . . 4.1799999999999997 110.624 178.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -87.21 -16.01 36.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.915 0.388 . . . . 5.8200000000000003 111.402 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -67.32 -29.67 69.31 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.836 -0.62 . . . . 4.7699999999999996 110.613 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -55.68 -56.71 22.36 Favored Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 115.913 -0.585 . . . . 5.0999999999999996 112.518 -178.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -75.6 -23.75 56.49 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.927 0.394 . . . . 5.7199999999999998 111.012 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -72.96 -12.26 60.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.019 0.438 . . . . 5.8799999999999999 109.917 179.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.619 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 0.1 OUTLIER -72.67 -31.46 65.08 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.74 -0.837 . . . . 7.3399999999999999 108.74 179.137 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -84.74 -12.46 53.69 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.249 -0.887 . . . . 6.9699999999999998 109.803 176.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . 0.64 ' HB3' ' CD2' ' A' ' 173' ' ' HIS . 46.2 mt-10 65.87 104.81 0.04 OUTLIER 'General case' 0 C--O 1.23 0.076 0 CA-C-N 115.116 -0.947 . . . . 6.9699999999999998 110.779 -177.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 -82.08 -38.2 25.25 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.472 -0.491 . . . . 9.3499999999999996 110.692 -177.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . 0.64 ' CD2' ' HB3' ' A' ' 171' ' ' GLU . 91.3 m-70 48.19 -157.84 0.06 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.442 -0.345 . . . . 11.4 111.494 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 64.5 m80 64.47 21.41 12.45 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.058 -0.519 . . . . 11.52 111.183 174.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -115.22 105.07 12.47 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.211 -0.449 . . . . 14.48 110.702 -177.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -106.54 157.09 17.93 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.474 -0.565 . . . . 15.369999999999999 109.474 177.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 49.5 p-80 -130.14 128.25 41.41 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.271 0.557 . . . . 16.02 111.331 -177.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 78.3 mt -106.33 -1.35 23.47 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.036 -0.728 . . . . 17.989999999999998 109.036 174.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -83.35 148.98 27.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.114 -0.948 . . . . 19.190000000000001 110.364 -179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 32.0 m80 -127.67 96.91 4.67 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.321 -0.4 . . . . 22.260000000000002 110.961 178.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 59.0 m80 65.76 -174.92 0.18 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.771 -0.649 . . . . 22.510000000000002 111.912 177.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -89.17 122.24 32.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.563 -0.744 . . . . 24.890000000000001 109.311 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -93.22 155.64 17.32 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.767 0.317 . . . . 25.579999999999998 110.66 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 48.1 p-80 -124.63 173.71 8.34 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.125 -0.489 . . . . 27.370000000000001 110.29 -178.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 11.1 p80 . . . . . 0 C--O 1.247 0.965 0 CA-C-N 116.315 -0.402 . . . . 29.059999999999999 110.354 178.751 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.263 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . 116.57 163.58 13.36 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 121.006 -0.616 . . . . 2.9700000000000002 112.004 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.815 ' HB2' HE22 ' A' ' 71' ' ' GLN . 16.4 m 65.1 -140.32 0.22 Allowed 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 122.375 0.27 . . . . 1.9399999999999999 110.848 178.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.526 ' HA ' HD22 ' B' 1008 ' ' LEU . 2.9 m 40.86 -79.3 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.345 0.374 0 C-N-CA 125.4 1.48 . . . . 1.6299999999999999 114.442 175.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 0.966 ' HA2' ' HA ' ' A' ' 86' ' ' VAL . . . -43.51 -62.19 2.59 Favored Glycine 0 N--CA 1.435 -1.405 0 C-N-CA 119.163 -1.494 . . . . 1.2 110.287 168.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -61.08 -42.16 97.99 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.932 0.345 . . . . 2.8799999999999999 111.932 177.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -70.91 -49.5 45.1 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.342 0.497 . . . . 1.3100000000000001 112.342 -171.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.722 ' HB2' HG23 ' A' ' 86' ' ' VAL . 2.1 mm? -73.82 -34.93 64.78 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.055 -0.258 . . . . 1.3300000000000001 110.425 -178.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 0.714 ' HB2' ' HB3' ' A' ' 89' ' ' GLU . . . -47.22 -47.52 24.47 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.983 0.897 . . . . 0.88 110.377 168.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.794 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -79.82 -58.42 3.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 114.026 -1.443 . . . . 1.03 111.881 -174.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.535 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 37.5 m-85 -61.65 -19.21 62.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 1.6699999999999999 111.15 -178.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.92 -25.08 72.52 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 121.033 -0.603 . . . . 0.78000000000000003 113.106 -178.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 31.1 t70 -77.05 5.83 7.43 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.411 0.624 . . . . 1.8999999999999999 110.513 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 35.3 m -101.5 4.62 41.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.028 -0.533 . . . . 1.4399999999999999 111.092 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.527 HD13 HG22 ' A' ' 101' ' ' VAL . 55.4 mt -79.85 67.41 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 121.903 0.859 . . . . 2.9100000000000001 110.045 178.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 36.4 t-20 -178.26 -51.62 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.431 -1.259 . . . . 4.29 107.66 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -134.84 98.67 4.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.971 -1.013 . . . . 8.1699999999999999 110.059 175.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.66 0 CA-C-N 116.427 -0.351 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.794 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.3 mmt . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 109.667 -0.494 . . . . 6.21 109.667 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.59 ' HB3' ' OD1' ' A' ' 135' ' ' ASN . 74.1 m -107.32 -37.12 6.33 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.001 0.429 . . . . 1.8700000000000001 111.369 179.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.438 ' O ' ' HB3' ' A' ' 6' ' ' ARG . 24.3 mp0 -70.74 -15.23 62.67 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.021 0.439 . . . . 2.4199999999999999 110.651 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.528 ' O ' ' HG ' ' A' ' 8' ' ' LEU . 5.1 p -68.7 -32.2 71.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.095 -0.502 . . . . 1.25 111.176 178.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.823 ' HB3' HD13 ' A' ' 134' ' ' LEU . 50.6 m-20 -62.15 -26.66 68.45 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.077 0.465 . . . . 1.78 110.127 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.567 ' O ' HG23 ' A' ' 10' ' ' VAL . 16.9 tpp85 -57.47 -49.36 76.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.491 -0.777 . . . . 1.3999999999999999 109.81 176.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.645 ' HG3' ' HB1' ' A' ' 37' ' ' ALA . 45.0 mt-10 -57.23 -44.99 84.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.528 -0.76 . . . . 0.68000000000000005 111.085 178.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.557 HD22 HG22 ' A' ' 46' ' ' VAL . 8.8 mt -60.65 -29.39 69.24 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.583 -1.189 . . . . 1.1599999999999999 110.117 -174.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.551 HG21 ' N ' ' A' ' 131' ' ' ALA . 55.9 t -80.65 -59.62 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.704 0 CA-C-N 115.05 -0.977 . . . . 0.27000000000000002 110.161 173.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 6' ' ' ARG . 99.4 t -52.28 -54.59 13.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.38 -0.827 . . . . 0.33000000000000002 112.466 -175.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -56.85 -35.86 69.35 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.996 0.427 . . . . 0.58999999999999997 110.355 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.532 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 8.2 t80 -72.38 -48.0 45.03 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.84 -0.618 . . . . 1.6100000000000001 110.469 -178.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.85 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.5 mp -61.66 -42.21 98.6 Favored 'General case' 0 C--N 1.338 0.098 0 C-N-CA 120.793 -0.363 . . . . 0.34000000000000002 110.516 177.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.8 t -58.97 -45.52 90.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.12 -0.491 . . . . 1.05 110.142 177.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -59.37 -33.83 71.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.469 -0.787 . . . . 1.22 110.936 178.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.712 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 8.6 mmpt? -75.96 -30.96 58.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.379 -0.373 . . . . 1.4099999999999999 111.932 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.552 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -70.25 -27.78 64.71 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.261 -0.576 . . . . 1.3500000000000001 110.265 176.511 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.3 m -58.8 -43.41 90.54 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.879 -0.601 . . . . 0.93999999999999995 112.315 -178.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -72.45 -2.75 20.68 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.28 0.562 . . . . 1.3700000000000001 111.551 -177.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.603 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 18.3 mmmt -109.64 -26.25 9.99 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.945 0.879 . . . . 2.2000000000000002 109.014 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.14 22.1 11.04 Favored Glycine 0 N--CA 1.443 -0.877 0 CA-C-N 113.829 -1.532 . . . . 0.53000000000000003 111.171 178.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.603 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 95.1 m-85 -114.17 165.52 12.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.942 0.401 . . . . 0.76000000000000001 110.827 -179.036 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.8 t -110.92 141.33 44.48 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.758 -0.656 . . . . 0.52000000000000002 109.906 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -65.72 -46.12 80.13 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.113 -0.494 . . . . 3.3599999999999999 110.01 174.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.3 p -64.75 -36.52 84.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.748 -0.66 . . . . 1.3700000000000001 111.836 -172.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -59.69 -31.01 69.17 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.073 0.463 . . . . 1.1100000000000001 111.24 178.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.502 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 15.8 m-85 -112.54 13.54 20.08 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.892 -0.594 . . . . 1.28 110.441 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.568 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 79.8 p -96.76 -179.29 4.53 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 121.69 0.757 . . . . 1.8100000000000001 111.511 -176.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.496 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.2 t70 -164.86 -26.06 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 113.98 -1.464 . . . . 2.3100000000000001 107.753 -177.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.938 HG23 ' H ' ' A' ' 31' ' ' GLU . 8.9 m -59.81 -75.11 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 113.734 -1.575 . . . . 0.92000000000000004 112.331 -177.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.938 ' H ' HG23 ' A' ' 30' ' ' VAL . 12.3 mm-40 -80.72 -7.87 59.49 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.618 -0.882 . . . . 2.7400000000000002 108.618 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 25.2 tt0 -66.11 -44.94 82.86 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.174 -1.376 . . . . 1.45 110.528 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -102.74 -49.72 3.74 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.944 -0.571 . . . . 1.8700000000000001 111.917 -175.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.494 ' HG2' ' O ' ' A' ' 30' ' ' VAL . 12.7 ptp180 -94.76 155.28 16.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.925 0.393 . . . . 3.3900000000000001 110.74 -178.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 31.9 p -125.44 115.02 19.6 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.996 -0.547 . . . . 2.25 110.365 176.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -137.15 -69.27 0.46 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.61 -0.723 . . . . 3.3399999999999999 110.461 -178.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.645 ' HB1' ' HG3' ' A' ' 7' ' ' GLU . . . -60.07 133.33 90.07 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 115.244 -0.889 . . . . 1.9199999999999999 111.86 -179.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.76 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 17.4 Cg_exo -68.3 -171.54 0.37 Allowed 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 124.032 3.155 . . . . 1.8700000000000001 112.005 176.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -90.57 13.06 16.9 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.484 0.659 . . . . 4.6399999999999997 110.397 177.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 134.4 66.19 0.07 OUTLIER Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.347 -0.842 . . . . 2.1499999999999999 111.225 -178.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.825 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.3 t -69.09 -76.97 0.09 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 120.756 -0.378 . . . . 1.1200000000000001 110.725 -174.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.825 ' H ' HG23 ' A' ' 41' ' ' THR . 15.9 pt-20 -95.56 -26.5 15.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 122.589 1.185 . . . . 2.02 108.762 167.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.774 ' HB2' ' HE3' ' A' ' 47' ' ' LYS . 1.4 p -55.78 -39.67 71.57 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 112.407 -2.179 . . . . 1.25 114.56 -169.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -39.66 -53.74 2.13 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.895 0.747 . . . . 1.9099999999999999 112.792 -169.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.15 -36.24 58.86 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.94 0.348 . . . . 0.52000000000000002 111.94 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.622 ' HB ' ' HB3' ' A' ' 148' ' ' TRP . 0.8 OUTLIER -69.98 -44.88 78.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 C-N-CA 121.012 -0.275 . . . . 1.4099999999999999 110.888 -176.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.774 ' HE3' ' HB2' ' A' ' 43' ' ' SER . 18.1 ptpt -64.16 -41.28 97.22 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.422 -0.584 . . . . 0.67000000000000004 109.422 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.696 HE21 ' HA ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -56.89 -34.93 68.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.357 -0.838 . . . . 0.98999999999999999 111.545 174.296 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.714 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -78.61 -33.86 47.11 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.234 0.54 . . . . 0.41999999999999998 110.501 178.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 12.5 mt -63.38 -33.66 76.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.484 -0.78 . . . . 1.3300000000000001 112.306 -177.165 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.658 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.3 ptp180 -79.49 -29.25 41.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.592 0.71 . . . . 2.1699999999999999 109.178 -174.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -70.27 -43.78 69.77 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.29 -1.323 . . . . 1.1000000000000001 110.655 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.28 -43.68 69.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.823 -0.626 . . . . 0.53000000000000003 110.526 176.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.633 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.66 -39.09 96.1 Favored Glycine 0 C--O 1.226 -0.346 0 CA-C-N 115.852 -0.613 . . . . 0.69999999999999996 111.815 178.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -53.59 -43.58 68.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.024 0.44 . . . . 1.04 110.463 178.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.675 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 37.5 mt-10 -69.97 -38.4 76.06 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.891 -0.595 . . . . 2.29 111.268 177.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.515 ' HE2' ' CZ ' ' A' ' 106' ' ' PHE . 7.3 t80 -65.16 -33.0 74.98 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.363 -0.381 . . . . 2.29 110.773 -174.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.633 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 33.6 mt-10 -65.35 -47.14 77.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.16 -0.473 . . . . 1.3 110.793 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.675 ' HG ' ' O ' ' A' ' 56' ' ' GLU . 4.6 pp -68.67 -31.26 70.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 1.54 110.638 -179.28 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.705 ' HB3' ' SG ' ' B' 1014 ' ' CYS . 47.3 mtt180 -68.77 -35.94 77.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.586 0.708 . . . . 2.5800000000000001 110.186 178.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.704 ' HB3' ' HB3' ' A' ' 65' ' ' PHE . 0.2 OUTLIER -91.5 0.04 57.55 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.925 -1.034 . . . . 5.3200000000000003 112.089 -177.718 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -35.81 -39.44 0.15 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.125 1.158 . . . . 4.4800000000000004 114.125 -172.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.5 ' NH1' ' O71' ' B' 1100 ' ' 33B . 34.6 ttm180 -75.46 -42.98 51.9 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 122.181 -0.324 . . . . 4.7199999999999998 111.7 -175.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.52 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -91.91 -41.19 10.73 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.786 0.661 . . . . 1.1699999999999999 112.786 -174.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.704 ' HB3' ' HB3' ' A' ' 61' ' ' TYR . 5.5 p90 -49.49 -40.71 38.39 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 113.524 0.935 . . . . 2.8100000000000001 113.524 -164.12 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 29.5 t -91.03 -42.36 10.56 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.934 0.397 . . . . 2.1899999999999999 110.39 -177.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -59.2 -28.64 66.83 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.619 0.723 . . . . 2.7200000000000002 110.955 179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.635 ' O ' HD12 ' A' ' 72' ' ' LEU . 1.8 mp -62.42 -17.06 58.41 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.029 -0.987 . . . . 1.5600000000000001 113.263 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.698 HG22 HG13 ' A' ' 74' ' ' ILE . 12.6 p -62.65 -22.9 66.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 118.397 0.544 . . . . 0.69999999999999996 112.058 -175.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.7 t -76.15 -35.14 59.35 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.017 -0.735 . . . . 1.3400000000000001 109.017 174.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.501 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 9.0 mt-30 -69.2 -47.41 64.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.816 -1.084 . . . . 1.4199999999999999 109.785 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.635 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mt -70.53 -32.02 69.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.602 -0.726 . . . . 1.3700000000000001 110.109 177.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 60.74 63.95 1.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.999 0.904 . . . . 2.7200000000000002 108.861 -172.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.761 HG21 ' HB3' ' A' ' 113' ' ' GLU . 29.3 mm -60.64 115.05 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 114.006 -1.452 . . . . 0.91000000000000003 111.382 -178.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.773 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -155.58 -172.26 0.31 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 107.963 -1.125 . . . . 0.51000000000000001 107.963 -171.463 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.773 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 17.8 Cg_exo -31.05 167.36 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.327 0 C-N-CA 125.029 3.819 . . . . 0.46999999999999997 115.091 165.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.501 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.85 -27.16 0.01 OUTLIER Glycine 0 N--CA 1.476 1.331 0 N-CA-C 117.372 1.709 . . . . 0.40000000000000002 117.372 -174.176 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.458 ' N ' ' O ' ' A' ' 76' ' ' PRO . 24.9 p -68.48 -0.36 4.92 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 117.909 0.855 . . . . 0.56000000000000005 111.925 177.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.32 -14.75 62.72 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.295 0.569 . . . . 0.34000000000000002 109.621 170.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -73.33 -25.99 60.85 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.577 -0.738 . . . . 4.1299999999999999 109.553 173.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.448 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 78.2 mt-30 -80.71 -31.98 35.94 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.902 0.858 . . . . 1.03 109.092 177.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.3 m -63.62 -54.21 39.43 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.015 -1.448 . . . . 0.47999999999999998 110.005 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.47 ' HA ' HG23 ' A' ' 86' ' ' VAL . 79.7 t80 -70.41 -18.49 63.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.365 -0.834 . . . . 1.1799999999999999 110.717 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.608 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.6 tt0 -59.21 -50.25 74.76 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.692 -0.686 . . . . 0.80000000000000004 110.46 176.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.554 ' OE1' HG21 ' B' 1004 ' ' VAL . 80.5 mt-30 -47.62 -32.45 5.57 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.596 -1.184 . . . . 1.6200000000000001 110.769 175.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.998 HG13 ' HG ' ' B' 1008 ' ' LEU . 1.6 t -84.1 -54.7 8.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-N 114.552 -1.203 . . . . 1.3 110.879 -176.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.608 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.3 p -60.69 -29.65 45.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.83 -0.623 . . . . 0.84999999999999998 109.989 -176.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.734 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 0.7 OUTLIER -58.22 -50.09 74.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.758 -1.11 . . . . 0.91000000000000003 110.687 175.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 1.002 ' HB3' ' HB2' ' B' 1009 ' ' ALA . 35.7 mm-40 -64.26 -42.79 96.32 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 122.331 1.062 . . . . 2.8700000000000001 109.391 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.489 HD12 ' HA ' ' A' ' 90' ' ' LEU . 0.3 OUTLIER -58.14 -25.48 61.49 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 112.692 -2.049 . . . . 1.28 112.814 -165.906 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.597 ' HA ' HG22 ' A' ' 95' ' ' VAL . 15.9 p90 -106.28 -22.15 12.91 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 120.62 -0.432 . . . . 2.2999999999999998 112.071 -174.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.734 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.7 OUTLIER -94.24 -29.59 15.01 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-O 121.257 0.551 . . . . 5.0599999999999996 111.298 -175.557 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.561 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 37.6 t70 -90.31 7.48 38.19 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.637 -0.71 . . . . 3.1200000000000001 112.685 -168.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 129.59 70.63 0.12 Allowed Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 117.125 -2.464 . . . . 2.3100000000000001 114.345 -177.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.597 HG22 ' HA ' ' A' ' 91' ' ' PHE . 48.6 t -71.65 101.52 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 122.399 1.095 . . . . 1.0600000000000001 111.302 -179.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.475 ' H ' ' CB ' ' A' ' 99' ' ' ARG . 0.7 OUTLIER -111.47 -179.87 3.83 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 113.745 -1.57 . . . . 2.1200000000000001 108.293 177.877 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.573 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 5.1 m95 -60.93 -52.43 65.05 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.81 0.338 . . . . 3.3399999999999999 111.002 177.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.474 ' HA3' HG23 ' B' 1015 ' ' ILE . . . -69.88 -20.0 75.69 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.926 -0.654 . . . . 0.68999999999999995 112.697 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.475 ' CB ' ' H ' ' A' ' 96' ' ' ASN . 4.7 tpp180 -67.24 -40.61 86.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.404 0.621 . . . . 4.2400000000000002 110.015 179.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.533 HG22 ' CE2' ' A' ' 104' ' ' PHE . 69.8 mt -72.17 -39.39 64.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.407 -0.815 . . . . 0.44 110.125 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 97' ' ' TRP . 55.2 t -53.44 -46.99 59.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.837 -0.619 . . . . 1.3500000000000001 110.233 172.278 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 99' ' ' ARG . . . -49.31 -51.71 32.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.179 -0.918 . . . . 0.44 110.888 174.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -54.63 -44.52 73.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.252 -0.886 . . . . 1.49 110.961 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.562 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 57.3 m-85 -64.77 -43.27 93.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.646 0.26 . . . . 3.29 111.146 176.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.515 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 27.3 m -60.9 -49.97 75.31 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.181 -0.463 . . . . 1.1899999999999999 110.864 -177.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.515 ' CZ ' ' HE2' ' A' ' 57' ' ' PHE . 33.0 m-85 -72.23 -33.63 67.7 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.399 -0.364 . . . . 2.8900000000000001 110.875 -179.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.706 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -69.07 -41.63 80.37 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.569 -0.825 . . . . 0.29999999999999999 111.879 177.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.85 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.46 -37.55 90.12 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.75 -0.738 . . . . 0.23000000000000001 111.483 176.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.21 -28.54 64.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.768 0.318 . . . . 0.31 110.482 176.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.607 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -64.02 -43.17 96.42 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 108.209 -1.034 . . . . 1.1200000000000001 108.209 179.286 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.661 ' HB2' HD23 ' A' ' 13' ' ' LEU . 19.5 t -53.27 -55.03 27.85 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 113.861 -1.518 . . . . 0.26000000000000001 110.534 173.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.437 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 71.8 t -63.36 -41.28 92.16 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.358 0 CA-C-N 116.127 -0.488 . . . . 0.34999999999999998 111.624 -178.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.761 ' HB3' HG21 ' A' ' 74' ' ' ILE . 37.2 mm-40 -63.7 -21.95 66.66 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.052 0.453 . . . . 2.5099999999999998 111.254 178.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.523 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 36.9 m -76.2 -40.86 51.24 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.618 -0.882 . . . . 0.28000000000000003 108.618 172.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 111' ' ' CYS . 81.0 t -66.62 -37.37 79.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.967 0.889 . . . . 1.23 109.628 -178.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -52.41 -50.21 62.96 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 113.38 -1.736 . . . . 0.59999999999999998 111.37 -179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.507 ' HE2' ' O ' ' A' ' 113' ' ' GLU . 11.2 mmtt -90.73 14.96 12.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.121 -0.491 . . . . 1.6200000000000001 110.525 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 63.55 53.12 2.14 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.81 0.814 . . . . 1.8799999999999999 111.075 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.543 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 25.5 mtm -130.1 44.27 2.99 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.804 -1.089 . . . . 0.31 108.073 178.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.494 ' HG2' HG13 ' A' ' 115' ' ' VAL . 4.5 mt-30 -60.92 -7.57 2.51 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.786 -1.097 . . . . 1.1499999999999999 113.068 -174.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.534 HG23 HD22 ' A' ' 122' ' ' LEU . 35.0 m -65.43 -26.04 38.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 O-C-N 122.225 -0.297 . . . . 0.46000000000000002 111.089 175.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.74 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -72.51 -27.75 62.45 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.463 -0.335 . . . . 0.26000000000000001 110.536 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.633 HG22 ' SG ' ' A' ' 111' ' ' CYS . 68.0 t -43.65 -53.03 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 O-C-N 123.968 0.793 . . . . 0.25 111.936 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.568 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 10.3 t -72.14 -40.46 68.04 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.748 0.309 . . . . 1.3500000000000001 110.932 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.74 ' HD2' HD13 ' A' ' 122' ' ' LEU . 92.0 mtt180 -59.98 -53.86 52.85 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-N 116.158 -0.474 . . . . 2.6699999999999999 110.589 -176.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.635 ' HA ' ' CZ2' ' A' ' 129' ' ' TRP . 87.2 mt -52.41 -48.4 45.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.361 -0.836 . . . . 0.23000000000000001 110.99 -178.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.563 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -60.14 -27.46 67.1 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.147 0.425 . . . . 0.28999999999999998 112.147 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.78 -61.41 2.08 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 121.486 0.66 . . . . 0.28000000000000003 110.358 -177.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.635 ' CZ2' ' HA ' ' A' ' 126' ' ' ILE . 27.3 p-90 -80.03 -18.07 51.13 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.169 -0.923 . . . . 3.9100000000000001 111.799 -176.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.706 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 12.4 mmm -58.12 -54.1 50.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.396 0.617 . . . . 1.0800000000000001 109.446 168.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.551 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -64.63 -41.52 96.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.586 -0.734 . . . . 0.25 110.888 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.541 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 70.1 m -57.9 -50.32 73.73 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.98 0.363 . . . . 0.40000000000000002 111.98 176.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.544 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 4.4 m-85 -59.34 -34.77 72.76 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 121.263 -0.175 . . . . 3.1299999999999999 111.194 -178.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.823 HD13 ' HB3' ' A' ' 5' ' ' ASN . 4.2 tt -62.02 -55.99 23.63 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.218 -1.03 . . . . 0.94999999999999996 108.218 170.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . 0.59 ' OD1' ' HB3' ' A' ' 2' ' ' SER . 6.0 m-80 -47.08 -51.3 18.01 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.114 -0.948 . . . . 0.46000000000000002 112.606 -178.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -84.76 -45.78 12.05 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.203 0.446 . . . . 0.58999999999999997 112.203 -173.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . 0.544 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 18.3 m-70 -91.02 -49.92 6.14 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.734 0.642 . . . . 1.45 112.734 -171.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 134' ' ' LEU . 46.7 mt -91.06 -36.75 13.85 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 112.784 0.661 . . . . 1.2 112.784 -165.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.637 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 31.5 tt0 -49.77 -50.73 65.7 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 123.54 0.525 . . . . 0.75 112.25 -173.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.597 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 35.2 Cg_exo -57.19 -49.84 12.9 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 121.61 1.54 . . . . 0.56000000000000005 111.494 176.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . 0.426 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 4.0 t-105 -57.74 -49.26 77.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.489 -0.778 . . . . 1.2 110.477 -178.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.619 HD12 ' HA ' ' A' ' 139' ' ' GLU . 47.0 mt -45.27 -53.32 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 C-N-CA 122.953 0.501 . . . . 0.32000000000000001 111.655 173.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.637 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.7 mm-40 -59.4 -32.35 70.08 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.91 -0.586 . . . . 0.56999999999999995 111.513 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.2 mm-40 -66.42 -19.38 65.78 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.248 0.547 . . . . 0.78000000000000003 110.909 178.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -109.75 2.5 20.11 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.478 -0.783 . . . . 0.93000000000000005 110.725 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 126.87 -48.32 0.97 Allowed Glycine 0 N--CA 1.442 -0.961 0 CA-C-N 115.669 -0.696 . . . . 0.56000000000000005 113.075 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 126.08 172.67 13.41 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.852 -0.69 . . . . 0.48999999999999999 111.45 -177.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.622 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 67.1 m95 -65.02 -36.42 84.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.901 0.351 . . . . 3.5699999999999998 111.611 -176.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.582 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 6.0 p-10 -59.95 -33.03 71.38 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.836 0.35 . . . . 1.96 110.634 177.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.547 ' O ' HD13 ' A' ' 154' ' ' LEU . 89.4 m -68.04 -39.99 82.93 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.047 -0.524 . . . . 0.67000000000000004 110.935 178.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.573 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 85.9 t80 -61.53 -33.03 73.13 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.942 -0.762 . . . . 3.0 108.942 179.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.582 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 99.0 t -63.08 -55.71 21.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-N 114.569 -1.196 . . . . 1.1499999999999999 110.786 174.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 9.5 mm-40 -47.76 -46.73 30.46 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.469 -0.787 . . . . 1.6699999999999999 111.538 177.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.547 HD13 ' O ' ' A' ' 150' ' ' THR . 8.4 mp -75.68 -61.18 2.01 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 113.233 0.827 . . . . 1.3 113.233 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -120.79 21.18 11.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.487 -0.324 . . . . 4.2400000000000002 111.822 -166.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.714 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -67.25 179.08 15.6 Favored Glycine 0 N--CA 1.45 -0.422 0 N-CA-C 115.729 1.051 . . . . 1.1000000000000001 115.729 -172.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -73.04 109.49 6.61 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 113.208 -1.496 . . . . 1.29 110.683 -177.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 1.009 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 4.0 m-20 -81.1 -7.77 59.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 112.613 0.598 . . . . 2.9900000000000002 112.613 -173.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.89 -36.21 76.48 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.303 -0.628 . . . . 2.52 109.303 171.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -100.21 -36.74 9.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.563 -0.744 . . . . 2.8700000000000001 110.751 174.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 1.009 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -55.11 -51.31 66.82 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.167 -0.47 . . . . 3.2000000000000002 111.862 -178.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.473 ' HG3' ' HB3' ' A' ' 158' ' ' ASN . 44.3 mt-10 -72.65 -27.47 62.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.783 0.325 . . . . 3.7200000000000002 110.842 -176.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 53.4 m -65.53 -30.54 71.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.14 0.495 . . . . 4.1799999999999997 110.266 175.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 37.3 mmt180 -91.48 -11.54 37.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.248 0.547 . . . . 5.8200000000000003 111.259 175.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.421 ' HB3' ' HA ' ' A' ' 162' ' ' GLU . 39.6 ttmt -84.28 -25.98 28.94 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.751 -0.658 . . . . 4.7699999999999996 110.988 -175.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -55.26 -45.13 83.95 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 121.155 -0.545 . . . . 5.0999999999999996 113.359 -174.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -80.12 -23.68 41.02 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 122.417 -0.461 . . . . 5.7199999999999998 111.135 -179.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -81.44 -5.4 57.87 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.677 0.751 . . . . 5.8799999999999999 109.17 178.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.571 ' HD2' ' O ' ' A' ' 169' ' ' ARG . 5.0 tmm_? -89.77 -29.05 18.94 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.085 -0.961 . . . . 7.3399999999999999 108.81 177.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 170' ' ' LEU . 4.3 mm? -84.08 -30.28 26.13 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.519 -0.764 . . . . 6.9699999999999998 109.997 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 73.12 144.88 0.07 Allowed 'General case' 0 C--O 1.234 0.255 0 O-C-N 124.415 1.072 . . . . 6.9699999999999998 112.065 172.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -83.17 125.25 31.33 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.179 -0.674 . . . . 9.3499999999999996 109.179 174.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -111.36 162.02 15.47 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.033 0.444 . . . . 11.4 111.484 -173.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 48.2 m80 -73.4 140.91 46.9 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.498 -0.774 . . . . 11.52 110.69 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -84.96 -24.75 28.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.948 -0.569 . . . . 14.48 109.511 175.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 74.5 m80 -124.89 109.73 13.39 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.726 -0.67 . . . . 15.369999999999999 109.494 176.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -138.28 -31.49 0.75 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.277 -0.42 . . . . 16.02 110.914 -175.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 98.8 mt 67.5 2.47 2.94 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.023 0.529 . . . . 17.989999999999998 111.5 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 59.85 -88.86 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 123.423 0.689 . . . . 19.190000000000001 111.982 -179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 183' ' ' HIS . 97.4 m-70 -123.03 141.15 52.27 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.731 -0.47 . . . . 22.260000000000002 109.731 -178.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -86.79 -41.77 13.82 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.371 -0.377 . . . . 22.510000000000002 110.809 -177.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 10.1 p80 -150.42 21.46 0.83 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.238 0.542 . . . . 24.890000000000001 110.291 178.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 180' ' ' HIS . 18.3 t60 -101.96 115.56 30.8 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.799 -0.637 . . . . 25.579999999999998 109.869 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -140.93 129.9 23.2 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.098 -0.501 . . . . 27.370000000000001 109.812 178.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 86.0 t60 . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.387 -0.816 . . . . 29.059999999999999 110.252 -179.454 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.237 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . 78.21 -71.72 2.41 Favored Glycine 0 N--CA 1.45 -0.433 0 O-C-N 121.7 -0.625 . . . . 2.9700000000000002 112.36 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . . . . . . . . . 9.8 m -119.36 -155.9 0.63 Allowed 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.8 -0.444 . . . . 1.9399999999999999 109.8 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.955 HG23 ' H ' ' B' 1005 ' ' GLY . 33.1 m 46.9 -84.68 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 O-C-N 124.547 1.154 . . . . 1.6299999999999999 112.92 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 0.955 ' H ' HG23 ' B' 1004 ' ' VAL . . . -37.15 -38.36 0.35 Allowed Glycine 0 CA--C 1.533 1.195 0 CA-C-N 119.219 0.918 . . . . 1.2 112.774 161.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . 0.527 ' HA ' ' CZ ' ' B' 1006 ' ' ARG . 1.6 tpm_? -56.32 -52.3 65.07 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.707 0.765 . . . . 2.8799999999999999 111.669 172.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . 0.767 ' HB2' ' H7 ' ' B' 1100 ' ' 33B . . . -99.67 -153.5 0.44 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 114.571 -1.195 . . . . 1.3100000000000001 110.063 -172.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.998 ' HG ' HG13 ' A' ' 86' ' ' VAL . 2.8 mm? 64.43 -74.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 O-C-N 123.963 0.789 . . . . 1.3300000000000001 111.384 174.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 1.002 ' HB2' ' HB3' ' A' ' 89' ' ' GLU . . . -46.06 -64.3 0.78 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.632 0.73 . . . . 0.88 110.574 169.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' B' 1013 ' ' ASP . . . -52.5 -40.06 61.97 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 114.597 -1.183 . . . . 1.03 112.43 -178.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.495 ' CG ' ' C13' ' B' 1100 ' ' 33B . 80.6 m-85 -98.75 7.02 46.55 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.188 -0.46 . . . . 1.6699999999999999 111.297 -172.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.79 -16.89 79.16 Favored Glycine 0 CA--C 1.501 -0.787 0 N-CA-C 108.726 -1.75 . . . . 0.78000000000000003 108.726 166.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . 0.419 ' HB3' ' O ' ' B' 1010 ' ' ALA . 17.4 t70 -72.78 -2.88 22.19 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.36 -1.42 . . . . 1.8999999999999999 110.863 171.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . 0.705 ' SG ' ' HB3' ' A' ' 60' ' ' ARG . 15.3 t -59.39 -37.38 77.84 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 121.334 0.588 . . . . 1.4399999999999999 110.057 178.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.474 HG23 ' HA3' ' A' ' 98' ' ' GLY . 14.6 tt -115.46 47.49 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.373 0 CA-C-O 122.437 1.113 . . . . 2.9100000000000001 109.531 -178.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 50.2 t-20 -75.47 -55.4 5.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.837 -1.074 . . . . 4.29 109.774 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 18.8 tpp180 -147.45 -74.51 0.2 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.948 -0.569 . . . . 8.1699999999999999 110.397 -177.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.586 0 CA-C-N 116.593 -0.276 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.767 ' H7 ' ' HB2' ' B' 1007 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.9 mtt . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 109.959 -0.385 . . . . 6.21 109.959 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.8 p -137.19 -48.19 0.59 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.827 0.346 . . . . 1.8700000000000001 110.906 178.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.448 ' O ' ' HB2' ' A' ' 37' ' ' ALA . 20.7 mp0 -79.8 1.43 26.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.865 0.364 . . . . 2.4199999999999999 111.257 -178.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -20.67 66.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.3 -0.409 . . . . 1.25 111.461 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.947 ' HA ' HD22 ' A' ' 8' ' ' LEU . 70.1 m-20 -64.65 -22.35 66.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.21 -0.45 . . . . 1.78 110.477 178.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.835 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.2 tpp180 -54.81 -52.95 61.09 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.814 -0.63 . . . . 1.3999999999999999 110.449 176.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.824 ' HB3' ' HE3' ' A' ' 47' ' ' LYS . 46.9 mt-10 -57.94 -46.39 85.13 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.274 -0.876 . . . . 0.68000000000000005 110.905 -177.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.947 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.2 OUTLIER -52.77 -32.49 43.94 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.078 -0.965 . . . . 1.1599999999999999 111.217 179.304 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.5 HG21 ' CA ' ' A' ' 131' ' ' ALA . 67.7 t -80.24 -61.1 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.308 0.575 . . . . 0.27000000000000002 109.8 174.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.527 HG13 ' CE2' ' A' ' 24' ' ' TRP . 95.2 t -50.1 -54.77 7.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.815 -1.084 . . . . 0.33000000000000002 112.506 -175.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -49.24 -43.28 42.59 Favored 'General case' 0 CA--C 1.52 -0.205 0 O-C-N 123.472 0.482 . . . . 0.58999999999999997 110.57 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.617 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 1.6 t80 -72.43 -42.44 65.06 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.879 -0.6 . . . . 1.6100000000000001 111.077 -175.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.993 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.2 mp -62.75 -40.39 97.11 Favored 'General case' 0 C--O 1.231 0.124 0 C-N-CA 120.277 -0.569 . . . . 0.34000000000000002 110.185 177.027 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.7 m -62.57 -39.11 92.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.553 0.692 . . . . 1.05 109.929 176.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -63.81 -18.7 64.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.739 -1.118 . . . . 1.22 111.024 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.681 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.7 mmpt? -90.57 -52.77 4.73 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.31 0.576 . . . . 1.4099999999999999 110.054 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.61 HD23 HG22 ' A' ' 112' ' ' VAL . 13.6 mt -55.36 -31.41 61.73 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.687 -1.142 . . . . 1.3500000000000001 111.419 177.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.8 t -60.41 -31.1 70.07 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.962 -0.563 . . . . 0.93999999999999995 111.621 177.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -75.68 -21.42 57.64 Favored 'General case' 0 CA--C 1.511 -0.53 0 CA-C-O 121.792 0.806 . . . . 1.3700000000000001 110.448 -178.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.537 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 9.8 mmmt -96.45 -26.58 15.26 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.224 -1.353 . . . . 2.2000000000000002 108.665 -174.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.03 19.4 17.08 Favored Glycine 0 N--CA 1.437 -1.295 0 CA-C-N 113.744 -1.571 . . . . 0.53000000000000003 111.976 176.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.537 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 31.8 m-85 -99.63 154.9 17.91 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.753 0.311 . . . . 0.76000000000000001 110.343 177.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.0 t -92.29 142.81 27.05 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.998 -0.546 . . . . 0.52000000000000002 109.572 175.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.527 ' CE2' HG13 ' A' ' 10' ' ' VAL . 27.9 t-105 -74.5 -49.44 22.13 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.622 -0.51 . . . . 3.3599999999999999 109.622 176.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.8 m -58.94 -35.89 73.86 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.771 -0.65 . . . . 1.3700000000000001 111.725 -176.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -61.64 -25.78 67.58 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.894 0.378 . . . . 1.1100000000000001 111.965 -178.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -120.24 19.15 12.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.358 -0.383 . . . . 1.28 110.933 -178.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.459 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 37.4 p -100.26 -178.85 3.95 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.625 0.726 . . . . 1.8100000000000001 112.097 -172.153 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.519 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 5.4 t70 -161.52 -23.9 0.05 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.403 -1.271 . . . . 2.3100000000000001 108.899 -178.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.866 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.4 m -53.91 -72.43 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 114.269 -1.332 . . . . 0.92000000000000004 112.827 -175.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.866 ' H ' HG23 ' A' ' 30' ' ' VAL . 32.4 mt-10 -89.69 -4.26 57.82 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.632 -0.877 . . . . 2.7400000000000002 108.632 178.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.519 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 23.2 tt0 -72.26 -52.32 16.87 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 114.45 -1.25 . . . . 1.45 111.222 -175.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -97.29 -34.24 11.15 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.978 0.362 . . . . 1.8700000000000001 111.978 -174.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -123.61 159.1 29.98 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.768 -0.373 . . . . 3.3900000000000001 110.393 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 16.7 p -120.69 103.67 9.3 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.467 0.651 . . . . 2.25 110.572 176.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.945 ' HG3' ' H ' ' A' ' 37' ' ' ALA . 10.3 pt-20 -101.06 -88.37 0.37 Allowed 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.363 -0.835 . . . . 3.3399999999999999 111.329 -179.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.945 ' H ' ' HG3' ' A' ' 36' ' ' GLU . . . -70.16 148.24 95.82 Favored Pre-proline 0 C--N 1.309 -1.169 0 CA-C-N 115.241 -0.891 . . . . 1.9199999999999999 111.503 178.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.78 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 76.3 Cg_exo -55.53 -173.27 0.03 OUTLIER 'Trans proline' 0 CA--C 1.535 0.542 0 C-N-CA 123.519 2.812 . . . . 1.8700000000000001 112.487 169.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -87.83 15.24 7.31 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.338 0.59 . . . . 4.6399999999999997 110.322 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 141.29 62.42 0.03 OUTLIER Glycine 0 N--CA 1.442 -0.923 0 CA-C-N 115.594 -0.73 . . . . 2.1499999999999999 111.739 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.805 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.2 t -68.8 -75.02 0.11 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 120.854 -0.338 . . . . 1.1200000000000001 110.547 -177.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.805 ' H ' HG23 ' A' ' 41' ' ' THR . 14.2 pt-20 -92.88 -30.95 15.15 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 122.27 1.033 . . . . 2.02 108.315 168.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.456 ' HA ' HG13 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -56.57 -35.57 68.33 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 112.742 -2.027 . . . . 1.25 113.425 -170.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -45.17 -53.48 8.09 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 123.967 0.792 . . . . 1.9099999999999999 111.721 -173.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.453 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -72.39 -38.96 68.34 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.794 0.294 . . . . 0.52000000000000002 111.794 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.68 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 1.4 m -71.47 -41.71 72.92 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 120.939 -0.305 . . . . 1.4099999999999999 111.016 -175.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.824 ' HE3' ' HB3' ' A' ' 7' ' ' GLU . 0.4 OUTLIER -71.77 -30.24 65.35 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.298 -0.63 . . . . 0.67000000000000004 109.298 178.742 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.525 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 3.1 mm100 -64.61 -35.68 81.79 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 116.117 -0.492 . . . . 0.98999999999999999 110.266 172.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.643 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -75.65 -34.23 60.5 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.114 -0.493 . . . . 0.41999999999999998 110.597 176.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.68 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 12.5 mt -64.02 -28.0 69.5 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 115.514 -0.767 . . . . 1.3300000000000001 112.364 -176.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.501 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 7.9 ptm180 -81.07 -30.72 34.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.861 0.839 . . . . 2.1699999999999999 108.998 -176.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -74.99 -49.93 18.28 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.172 -1.376 . . . . 1.1000000000000001 109.786 -178.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.415 ' CB ' ' HZ ' ' A' ' 151' ' ' PHE . . . -65.45 -34.12 77.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.724 -0.671 . . . . 0.53000000000000003 109.87 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.761 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -58.7 -57.33 20.42 Favored Glycine 0 N--CA 1.442 -0.911 0 CA-C-N 115.262 -0.881 . . . . 0.69999999999999996 111.758 177.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -55.12 -43.16 73.82 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.807 0.337 . . . . 1.04 111.265 -177.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.441 ' CD ' HH21 ' B' 1017 ' ' ARG . 27.3 mm-40 -59.5 -34.25 72.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.771 -0.65 . . . . 2.29 111.479 177.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.621 ' CE1' ' HA2' ' B' 1012 ' ' GLY . 67.0 t80 -81.6 -40.48 22.93 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.912 -0.585 . . . . 2.29 111.323 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.761 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 56.9 mt-10 -62.92 -42.19 99.72 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.314 -0.403 . . . . 1.3 111.745 -173.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.1 pp -59.73 -19.09 47.88 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.22 -0.446 . . . . 1.54 111.526 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 32.8 mtp-105 -79.7 -53.67 6.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.087 -0.506 . . . . 2.5800000000000001 110.953 -179.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.647 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 15.3 p90 -92.18 -5.72 52.04 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.672 0.619 . . . . 5.3200000000000003 112.672 -172.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.807 ' HG3' ' HE1' ' A' ' 65' ' ' PHE . 50.8 ttt180 -50.99 -38.49 51.45 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.28 0.474 . . . . 4.4800000000000004 112.28 -170.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -52.85 -38.14 61.11 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.051 0.389 . . . . 4.7199999999999998 112.051 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.427 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -82.78 -48.82 10.39 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 112.906 0.706 . . . . 1.1699999999999999 112.906 -172.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.807 ' HE1' ' HG3' ' A' ' 62' ' ' ARG . 5.1 p90 -60.04 -26.99 66.55 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.49 0.552 . . . . 2.8100000000000001 112.49 -166.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.1 t -68.02 -32.71 73.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.154 0.502 . . . . 2.1899999999999999 110.106 177.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -90.13 -25.82 20.5 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.583 0.706 . . . . 2.7200000000000002 110.397 177.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.69 ' O ' HD12 ' A' ' 72' ' ' LEU . 2.0 mp -75.31 -18.02 60.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.292 -0.867 . . . . 1.5600000000000001 112.424 -176.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.709 HG22 HG13 ' A' ' 74' ' ' ILE . 1.2 p -57.3 -34.42 68.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 118.147 0.431 . . . . 0.69999999999999996 111.043 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 45.6 t -63.88 -41.7 97.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.385 0.612 . . . . 1.3400000000000001 109.924 173.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.657 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 9.0 mt-30 -66.77 -39.12 87.74 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.113 -0.949 . . . . 1.4199999999999999 110.652 -178.196 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.69 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mt -76.2 -30.15 57.89 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.552 -0.749 . . . . 1.3700000000000001 110.408 178.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 89.5 m-70 68.55 50.72 0.67 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.447 0.642 . . . . 2.7200000000000002 109.616 -176.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.709 HG13 HG22 ' A' ' 69' ' ' THR . 25.5 mm -55.47 114.93 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 114.609 -1.178 . . . . 0.91000000000000003 111.419 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.765 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.95 -170.24 0.24 Allowed Pre-proline 0 CA--C 1.549 0.923 0 N-CA-C 107.514 -1.291 . . . . 0.51000000000000001 107.514 -171.566 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.765 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 32.2 Cg_exo -29.33 167.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.128 0 C-N-CA 125.218 3.945 . . . . 0.46999999999999997 115.326 162.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -28.56 -27.46 0.0 OUTLIER Glycine 0 N--CA 1.475 1.239 0 N-CA-C 117.828 1.891 . . . . 0.40000000000000002 117.828 -173.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.469 ' N ' ' O ' ' A' ' 76' ' ' PRO . 40.7 p -65.67 1.93 1.13 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 118.946 1.373 . . . . 0.56000000000000005 112.0 177.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.26 -12.16 60.76 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.551 -0.295 . . . . 0.34000000000000002 110.262 174.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.463 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 2.8 m-85 -73.62 -22.85 59.88 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.644 -0.872 . . . . 4.1299999999999999 108.644 174.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.408 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 33.5 mt-30 -81.95 -26.15 34.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.392 -0.822 . . . . 1.03 109.725 176.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.647 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 3.2 m -73.54 -51.51 16.72 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.63 -1.168 . . . . 0.47999999999999998 109.05 172.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.46 ' HB2' ' HG ' ' A' ' 110' ' ' LEU . 69.3 t80 -67.66 -17.89 64.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.115 -0.948 . . . . 1.1799999999999999 110.276 176.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.552 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.5 tt0 -61.64 -50.56 72.05 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-N 115.925 -0.579 . . . . 0.80000000000000004 110.409 177.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -47.23 -33.33 5.31 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 114.856 -1.066 . . . . 1.6200000000000001 110.311 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.872 HG13 HD12 ' B' 1008 ' ' LEU . 1.3 t -85.91 -55.13 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.981 0 CA-C-N 114.01 -1.45 . . . . 1.3 110.912 -174.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.552 HG12 ' HA ' ' A' ' 84' ' ' GLU . 4.9 p -62.86 -17.95 20.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-O 122.098 0.951 . . . . 0.84999999999999998 109.959 -176.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.547 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 4.5 m-80 -86.02 -35.58 20.26 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.148 -1.387 . . . . 0.91000000000000003 112.057 176.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 1.022 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.2 pp20? -74.65 -35.58 62.85 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 122.107 0.956 . . . . 2.8700000000000001 108.518 177.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.625 HD13 ' OE2' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -67.13 -33.36 75.28 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 113.569 -1.651 . . . . 1.28 110.879 -167.921 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.671 ' HA ' HG22 ' A' ' 95' ' ' VAL . 2.9 p90 -98.53 -16.62 19.09 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.774 -0.37 . . . . 2.2999999999999998 111.097 -174.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.615 ' CD ' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -88.81 -30.15 19.19 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.35 -0.54 . . . . 5.0599999999999996 111.139 -177.179 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -92.24 2.63 56.5 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.662 0.616 . . . . 3.1200000000000001 112.662 -168.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 131.67 71.78 0.1 OUTLIER Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 117.339 -2.362 . . . . 2.3100000000000001 114.954 -174.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.671 HG22 ' HA ' ' A' ' 91' ' ' PHE . 49.1 t -70.14 98.52 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 118.144 0.972 . . . . 1.0600000000000001 110.492 178.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.617 ' N ' HD22 ' A' ' 96' ' ' ASN . 0.7 OUTLIER -108.93 -179.06 3.75 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.311 -1.313 . . . . 2.1200000000000001 108.902 178.1 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.809 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 19.3 m-90 -51.37 -52.9 41.6 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.224 0.535 . . . . 3.3399999999999999 111.015 176.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.791 ' HA3' HG21 ' B' 1015 ' ' ILE . . . -81.36 -14.18 79.12 Favored Glycine 0 CA--C 1.519 0.324 0 CA-C-N 115.759 -0.655 . . . . 0.68999999999999995 113.637 -175.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.625 ' HD2' HD12 ' A' ' 90' ' ' LEU . 9.4 tpp180 -63.21 -42.4 99.28 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.291 0.567 . . . . 4.2400000000000002 110.496 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.569 HG22 ' CE2' ' A' ' 104' ' ' PHE . 89.8 mt -72.89 -33.61 44.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.671 . . . . 0.44 110.438 -179.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.521 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 72.8 t -49.1 -54.45 5.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.764 -0.653 . . . . 1.3500000000000001 109.804 168.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.423 ' HB1' ' CE2' ' A' ' 106' ' ' PHE . . . -52.49 -47.22 66.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.886 -1.052 . . . . 0.44 111.126 175.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.404 ' CE1' HG23 ' A' ' 87' ' ' VAL . 9.7 t80 -55.56 -39.67 70.94 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.579 -0.737 . . . . 1.49 111.395 178.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.569 ' CE2' HG22 ' A' ' 100' ' ' ILE . 30.7 m-85 -69.92 -33.74 72.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.632 0.253 . . . . 3.29 110.88 175.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.617 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 18.1 t -68.58 -53.84 20.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.484 -0.325 . . . . 1.1899999999999999 110.674 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.553 ' CZ ' ' HB3' ' B' 1008 ' ' LEU . 35.4 m-85 -63.98 -38.63 91.78 Favored 'General case' 0 C--O 1.225 -0.195 0 CA-C-O 120.552 0.215 . . . . 2.8900000000000001 110.581 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -69.82 -39.18 76.32 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.619 -0.801 . . . . 0.29999999999999999 111.792 177.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.993 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.04 -36.19 91.63 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 111.303 -0.719 . . . . 0.23000000000000001 111.303 176.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -73.59 -29.14 62.21 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.229 -0.285 . . . . 0.31 110.229 175.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.46 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -61.3 -40.68 95.07 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 107.723 -1.214 . . . . 1.1200000000000001 107.723 178.155 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.717 ' SG ' HG22 ' A' ' 123' ' ' VAL . 39.9 t -51.57 -63.73 1.04 Allowed 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 113.612 -1.631 . . . . 0.26000000000000001 110.174 172.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.896 ' HA ' HG13 ' A' ' 115' ' ' VAL . 43.6 t -64.15 -37.89 81.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.202 0.445 . . . . 0.34999999999999998 112.202 -174.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.614 ' HB3' HG21 ' A' ' 74' ' ' ILE . 13.6 mm-40 -59.52 -16.95 27.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.185 0.517 . . . . 2.5099999999999998 110.767 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.578 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 63.9 m -85.1 -46.86 10.74 Favored 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 107.997 -1.112 . . . . 0.28000000000000003 107.997 176.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.896 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.7 m -66.38 -34.22 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-N 114.783 -1.099 . . . . 1.23 109.897 -174.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -50.32 -51.31 46.45 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 113.066 -1.879 . . . . 0.59999999999999998 111.153 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' ' 113' ' ' GLU . 24.1 mmtt -86.0 15.5 4.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.796 -0.638 . . . . 1.6200000000000001 110.109 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.496 ' HA ' ' NE2' ' A' ' 120' ' ' GLN . 39.0 mt-10 65.89 49.29 1.67 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 122.037 0.922 . . . . 1.8799999999999999 110.176 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.578 ' CE ' ' HA ' ' A' ' 114' ' ' SER . 27.9 mtm -129.59 37.12 4.02 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.329 -1.305 . . . . 0.31 107.889 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.771 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 1.9 mp0 -54.51 -8.05 0.2 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 114.921 -1.036 . . . . 1.1499999999999999 112.684 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.578 HG23 HD22 ' A' ' 122' ' ' LEU . 27.3 m -68.25 -22.5 27.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 O-C-N 122.102 -0.374 . . . . 0.46000000000000002 111.868 176.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.615 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.6 mm? -75.26 -24.89 57.66 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-O 120.956 0.408 . . . . 0.26000000000000001 110.137 178.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.717 HG22 ' SG ' ' A' ' 111' ' ' CYS . 46.7 t -45.19 -52.55 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 114.857 -1.065 . . . . 0.25 112.346 -176.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.459 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 0.1 OUTLIER -75.46 -33.59 60.86 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 121.044 0.449 . . . . 1.3500000000000001 111.196 -178.468 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.615 ' HD2' HD13 ' A' ' 122' ' ' LEU . 74.0 mtt180 -65.97 -52.5 49.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.67 -0.695 . . . . 2.6699999999999999 110.738 -176.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.553 HG22 ' SD ' ' A' ' 130' ' ' MET . 69.5 mt -53.6 -49.97 52.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.769 -0.651 . . . . 0.23000000000000001 111.331 179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.641 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.17 -32.53 68.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.624 -0.262 . . . . 0.28999999999999998 111.58 -177.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.835 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -58.75 -61.68 2.44 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.198 0.523 . . . . 0.28000000000000003 110.353 176.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -62.11 -35.67 79.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.86 -1.064 . . . . 3.9100000000000001 111.2 -176.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.553 ' SD ' HG22 ' A' ' 126' ' ' ILE . 88.2 mtp -60.86 -54.59 43.18 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.779 0.323 . . . . 1.0800000000000001 111.435 178.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.5 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -62.23 -43.01 99.79 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.26 -0.427 . . . . 0.25 111.004 -178.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 97.2 m -61.4 -44.39 97.23 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.838 -0.345 . . . . 0.40000000000000002 110.695 177.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.458 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 26.6 t80 -56.7 -40.24 75.27 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.153 -0.314 . . . . 3.1299999999999999 110.153 178.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.925 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 3.8 tt -61.42 -54.88 37.8 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.78 -0.822 . . . . 0.94999999999999996 108.78 174.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -51.75 -44.02 63.16 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.181 -0.918 . . . . 0.46000000000000002 112.426 -178.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -84.68 -52.69 5.9 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.215 0.531 . . . . 0.58999999999999997 111.906 -175.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . 0.458 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 7.2 m80 -91.4 -51.77 5.12 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 113.124 0.787 . . . . 1.45 113.124 -171.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.925 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -80.74 -45.6 16.8 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 114.007 1.114 . . . . 1.2 114.007 -165.081 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.712 ' HA ' HD12 ' A' ' 142' ' ' ILE . 27.6 tt0 -44.99 -50.29 26.74 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 112.689 0.626 . . . . 0.75 112.689 -174.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.571 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 51.3 Cg_exo -54.38 -50.87 12.0 Favored 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 121.856 1.704 . . . . 0.56000000000000005 111.861 176.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.2 t-105 -58.02 -49.5 76.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.529 -0.759 . . . . 1.2 110.31 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.712 HD12 ' HA ' ' A' ' 139' ' ' GLU . 61.8 mt -46.58 -53.91 2.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.921 -0.581 . . . . 0.32000000000000001 111.683 175.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.563 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 72.3 mm-40 -60.14 -30.72 69.48 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.846 -0.616 . . . . 0.56999999999999995 111.739 -178.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 6.4 mm-40 -68.28 -22.9 64.71 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.354 0.597 . . . . 0.78000000000000003 110.746 177.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.633 ' N ' HD22 ' A' ' 145' ' ' ASN . 0.7 OUTLIER -99.54 -20.9 16.15 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.421 -0.808 . . . . 0.93000000000000005 110.151 -173.071 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 146.7 -33.57 1.4 Allowed Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.791 -0.719 . . . . 0.56000000000000005 112.686 175.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.551 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 110.1 169.92 19.89 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.565 -0.826 . . . . 0.48999999999999999 111.844 -177.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.533 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 65.2 m95 -68.03 -34.39 76.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.731 0.265 . . . . 3.5699999999999998 111.568 -178.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -58.25 -47.1 84.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.067 0.46 . . . . 1.96 110.243 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.542 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 95.4 m -61.0 -35.37 76.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.606 -0.724 . . . . 0.67000000000000004 111.178 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.809 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 84.0 t80 -59.54 -40.96 88.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.742 0.306 . . . . 3.0 110.672 -178.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.559 HG12 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -73.8 -24.94 20.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.322 0.582 . . . . 1.1499999999999999 110.089 178.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.78 -22.45 66.03 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.066 0.46 . . . . 1.6699999999999999 109.948 173.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 150' ' ' THR . 5.0 mt -94.33 -58.34 2.24 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.916 -0.584 . . . . 1.3 110.779 177.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -121.25 27.74 8.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.976 -0.556 . . . . 4.2400000000000002 111.591 -173.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.643 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -65.7 163.43 40.24 Favored Glycine 0 CA--C 1.497 -1.083 0 C-N-CA 120.865 -0.683 . . . . 1.1000000000000001 113.056 -178.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.525 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 24.9 t-20 -63.64 108.68 1.46 Allowed 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 114.205 -0.998 . . . . 1.29 110.68 178.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.744 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 6.0 m120 -82.0 -24.04 35.65 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.322 -0.399 . . . . 2.9900000000000002 111.414 -177.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -53.97 -45.13 71.26 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-O 120.773 0.321 . . . . 2.52 111.109 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -82.37 -35.55 27.67 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.237 -0.438 . . . . 2.8700000000000001 110.556 177.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.556 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -55.12 -60.83 2.84 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.844 -0.616 . . . . 3.2000000000000002 111.284 -179.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.744 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 10.4 pt-20 -65.92 -29.15 69.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.65 -0.25 . . . . 3.7200000000000002 111.531 -179.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 37.6 t -64.77 -40.31 95.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.129 0.49 . . . . 4.1799999999999997 110.139 -178.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -90.5 -0.47 57.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.978 -0.555 . . . . 5.8200000000000003 110.379 178.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.561 ' HB3' ' HA ' ' A' ' 162' ' ' GLU . 34.0 ttpt -100.3 -56.15 2.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.549 -0.75 . . . . 4.7699999999999996 111.267 -177.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -65.7 -11.92 55.15 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.585 -0.734 . . . . 5.0999999999999996 113.491 -172.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -68.93 -21.43 64.2 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.951 0.376 . . . . 5.7199999999999998 110.368 176.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -76.0 -5.91 48.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.982 -0.554 . . . . 5.8799999999999999 110.571 176.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.593 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 1.1 tmt_? -85.74 -28.8 24.36 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.288 -0.634 . . . . 7.3399999999999999 109.288 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 170' ' ' LEU . 3.7 mm? -99.87 -63.51 1.12 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.907 -0.588 . . . . 6.9699999999999998 110.121 -179.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -113.66 -158.7 0.67 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.08 -0.711 . . . . 6.9699999999999998 109.08 176.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 54.5 m80 -139.7 116.06 10.57 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.05 0.452 . . . . 9.3499999999999996 110.833 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 30.9 t60 -83.94 -36.24 23.42 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.735 -0.666 . . . . 11.4 109.641 -179.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -76.92 -48.44 18.21 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.737 -0.665 . . . . 11.52 110.242 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 60.3 t60 -84.7 105.97 15.9 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.008 -0.542 . . . . 14.48 110.465 177.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 35.8 m-70 -84.17 110.99 18.94 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.384 -0.371 . . . . 15.369999999999999 110.197 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 29.6 t-80 -67.69 -38.27 83.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.914 -0.585 . . . . 16.02 111.072 -178.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 39.2 tp 65.19 106.83 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.13 0 O-C-N 123.919 0.762 . . . . 17.989999999999998 110.409 -176.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 46.9 mm-40 -75.05 170.22 16.45 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.284 -0.416 . . . . 19.190000000000001 111.007 -177.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -69.32 121.4 16.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.932 -0.576 . . . . 22.260000000000002 110.851 -177.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 44.2 m80 -72.39 125.64 27.88 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.989 -0.551 . . . . 22.510000000000002 110.91 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -81.58 153.57 26.66 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.891 -0.595 . . . . 24.890000000000001 110.273 177.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 66.65 32.07 7.29 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 123.51 0.506 . . . . 25.579999999999998 110.909 -178.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -121.27 75.7 1.18 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.262 -0.426 . . . . 27.370000000000001 110.549 178.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 52.1 m80 . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.205 -0.902 . . . . 29.059999999999999 109.906 175.732 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.158 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -73.47 -40.91 46.47 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.926 -0.654 . . . . 2.9700000000000002 112.592 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.522 ' HB2' HE22 ' A' ' 71' ' ' GLN . 5.1 m -122.9 -150.46 0.45 Allowed 'General case' 0 C--N 1.324 -0.511 0 O-C-N 122.458 -0.437 . . . . 1.9399999999999999 110.512 -176.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.911 ' HA ' ' HG ' ' B' 1008 ' ' LEU . 10.8 m 42.27 -92.42 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 O-C-N 124.515 1.135 . . . . 1.6299999999999999 112.992 175.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 0.677 ' H ' HG23 ' B' 1004 ' ' VAL . . . -31.56 -42.57 0.1 OUTLIER Glycine 0 CA--C 1.529 0.937 0 CA-C-N 118.351 0.523 . . . . 1.2 113.708 164.566 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -94.07 -40.48 10.05 Favored 'General case' 0 C--O 1.225 -0.221 0 N-CA-C 111.922 0.341 . . . . 2.8799999999999999 111.922 176.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . 0.578 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -78.52 -48.16 15.87 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 113.119 0.785 . . . . 1.3100000000000001 113.119 -167.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.911 ' HG ' ' HA ' ' B' 1004 ' ' VAL . 7.7 mt -75.22 -37.31 61.17 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.279 -0.637 . . . . 1.3300000000000001 109.279 -171.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 1.022 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -52.86 -49.79 65.09 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.002 -0.999 . . . . 0.88 110.169 169.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.781 ' HB1' ' N11' ' B' 1100 ' ' 33B . . . -68.28 -50.18 55.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.283 -1.326 . . . . 1.03 111.966 -176.106 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.613 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 34.1 m-85 -73.14 -23.17 60.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.138 -0.483 . . . . 1.6699999999999999 111.478 -177.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . 0.621 ' HA2' ' CE1' ' A' ' 57' ' ' PHE . . . -74.61 -10.1 82.66 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 121.018 -0.611 . . . . 0.78000000000000003 113.01 -177.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 29.2 t70 -74.51 -20.96 59.78 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.08 0.467 . . . . 1.8999999999999999 110.898 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -98.03 93.16 6.14 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 116.447 -0.342 . . . . 1.4399999999999999 110.886 -175.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.791 HG21 ' HA3' ' A' ' 98' ' ' GLY . 19.1 pt -115.19 37.79 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.576 0.703 . . . . 2.9100000000000001 110.61 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 20.8 p30 -155.3 29.87 0.39 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.294 -0.866 . . . . 4.29 109.997 -176.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . 0.441 HH21 ' CD ' ' A' ' 56' ' ' GLU . 17.8 mmt180 61.38 79.88 0.24 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.368 -0.833 . . . . 8.1699999999999999 110.645 -174.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 116.306 -0.407 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.781 ' N11' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.6 ptt? . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 121.665 0.745 . . . . 6.21 110.323 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.0 m -87.11 125.25 34.02 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.48 -0.782 . . . . 1.8700000000000001 110.887 -177.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.479 ' O ' ' HB2' ' A' ' 37' ' ' ALA . 72.1 mm-40 -64.03 -25.4 68.1 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.08 0.467 . . . . 2.4199999999999999 110.13 176.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.11 -17.69 64.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.458 -0.792 . . . . 1.25 112.467 -177.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.894 ' HB3' HD13 ' A' ' 134' ' ' LEU . 21.8 m-20 -67.86 -15.76 63.77 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 120.52 -0.472 . . . . 1.78 110.005 178.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.561 HH12 ' HA ' ' A' ' 128' ' ' ALA . 12.3 tpp180 -56.83 -48.91 76.95 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.921 -0.581 . . . . 1.3999999999999999 109.747 174.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.512 ' OE1' ' HA2' ' A' ' 40' ' ' GLY . 33.9 mt-10 -53.49 -51.81 61.58 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.768 -1.105 . . . . 0.68000000000000005 111.118 -178.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.623 HD22 ' HA ' ' A' ' 5' ' ' ASN . 1.2 mp -49.13 -35.04 15.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.864 -1.062 . . . . 1.1599999999999999 111.499 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.523 HG21 ' N ' ' A' ' 131' ' ' ALA . 72.4 t -80.63 -59.54 2.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.837 -0.62 . . . . 0.27000000000000002 110.375 175.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 6' ' ' ARG . 85.0 t -51.96 -55.64 8.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 114.852 -1.067 . . . . 0.33000000000000002 113.059 -176.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -54.97 -30.85 60.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.974 0.416 . . . . 0.58999999999999997 110.493 -176.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.74 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 4.0 t80 -79.18 -51.51 9.41 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.889 -0.596 . . . . 1.6100000000000001 110.546 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.952 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.0 mp -58.89 -42.95 90.77 Favored 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 121.01 -0.276 . . . . 0.34000000000000002 110.899 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.43 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 38.4 t -58.39 -40.43 82.33 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.283 0.563 . . . . 1.05 110.424 178.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -71.56 -23.75 61.81 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.795 -0.639 . . . . 1.22 110.289 -179.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.631 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.2 mmpt? -85.1 -28.78 25.36 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 116.457 -0.338 . . . . 1.4099999999999999 110.929 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.481 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -72.73 -26.33 61.54 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.066 -0.654 . . . . 1.3500000000000001 109.396 172.783 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.7 t -65.18 -33.78 76.82 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.58 -0.736 . . . . 0.93999999999999995 111.735 -178.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 16.8 pt20 -76.11 -6.04 49.35 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.367 0.603 . . . . 1.3700000000000001 111.022 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.526 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.5 mmmt -109.01 -27.78 9.46 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.961 0.886 . . . . 2.2000000000000002 108.854 -178.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.4 23.25 9.69 Favored Glycine 0 N--CA 1.441 -1.009 0 CA-C-N 113.996 -1.457 . . . . 0.53000000000000003 111.438 177.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.508 ' HD2' ' HZ ' ' A' ' 27' ' ' PHE . 84.4 m-85 -110.55 163.58 13.57 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.033 0.444 . . . . 0.76000000000000001 111.003 179.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.8 t -101.42 145.37 29.04 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.821 -0.627 . . . . 0.52000000000000002 110.176 -179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.43 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.5 OUTLIER -69.78 -47.46 62.82 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.044 -0.526 . . . . 3.3599999999999999 110.713 176.573 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.7 t -75.6 -23.18 56.43 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.417 -0.356 . . . . 1.3700000000000001 111.599 -170.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -61.39 -25.47 67.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.222 0.534 . . . . 1.1100000000000001 111.124 176.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.508 ' HZ ' ' HD2' ' A' ' 22' ' ' TYR . 6.6 m-85 -113.09 -22.21 10.66 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.979 -0.555 . . . . 1.28 111.16 -176.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.581 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 19.3 m -101.24 144.87 29.58 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-O 122.32 1.057 . . . . 1.8100000000000001 112.163 -178.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -118.18 -5.21 10.92 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 113.379 -1.737 . . . . 2.3100000000000001 109.512 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.793 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.4 m -53.57 -73.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.135 -1.393 . . . . 0.92000000000000004 113.257 -165.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.793 ' H ' HG23 ' A' ' 30' ' ' VAL . 10.4 pt-20 -96.97 2.12 51.15 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.122 -0.696 . . . . 2.7400000000000002 109.122 177.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -71.29 -57.68 4.24 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.761 -1.108 . . . . 1.45 110.803 179.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 47.4 m-80 -89.54 -55.11 3.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.779 -0.646 . . . . 1.8700000000000001 110.833 -174.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -91.42 157.04 17.3 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.148 -0.686 . . . . 3.3900000000000001 109.148 174.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 16.6 p -103.6 108.0 19.08 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.426 0.631 . . . . 2.25 110.834 -178.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -103.77 -84.25 0.48 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.306 -0.861 . . . . 3.3399999999999999 110.584 -176.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 3' ' ' GLN . . . -101.5 151.65 37.86 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.007 -0.542 . . . . 1.9199999999999999 111.182 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.763 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 32.5 Cg_exo -61.44 169.6 6.43 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.904 2.403 . . . . 1.8700000000000001 110.912 168.509 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -81.23 -1.8 46.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.347 0.594 . . . . 4.6399999999999997 110.825 -178.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.512 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 170.36 68.42 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.639 -0.71 . . . . 2.1499999999999999 111.798 176.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.894 HG23 ' H ' ' A' ' 42' ' ' GLU . 3.5 t -80.5 -75.36 0.27 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 120.351 -0.54 . . . . 1.1200000000000001 110.543 -177.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.894 ' H ' HG23 ' A' ' 41' ' ' THR . 13.4 pt-20 -94.45 -32.19 13.64 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-O 122.384 1.088 . . . . 2.02 109.789 171.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.685 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 51.7 m -62.71 -24.53 67.71 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 113.206 -1.815 . . . . 1.25 114.816 -165.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -39.42 -55.52 1.75 Allowed 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.517 0.511 . . . . 1.9099999999999999 112.251 -172.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.475 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -70.52 -40.07 73.72 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.796 0.295 . . . . 0.52000000000000002 111.796 179.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.631 ' HB ' ' HB3' ' A' ' 148' ' ' TRP . 2.0 m -67.74 -44.2 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 121.239 -0.185 . . . . 1.4099999999999999 111.189 -176.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.685 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.8 ptpt -69.93 -39.42 76.12 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.536 -0.542 . . . . 0.67000000000000004 109.536 179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.539 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 6.0 mm100 -59.1 -33.62 71.05 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.714 -0.676 . . . . 0.98999999999999999 111.17 174.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.54 ' CB ' ' HA2' ' A' ' 156' ' ' GLY . . . -76.83 -39.41 51.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.39 0.614 . . . . 0.41999999999999998 110.716 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.422 HD12 ' CE2' ' A' ' 151' ' ' PHE . 1.0 OUTLIER -65.79 -25.97 67.48 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.286 -0.87 . . . . 1.3300000000000001 112.548 -174.63 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.539 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.2 ptp180 -83.34 -27.46 29.7 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.8 0.81 . . . . 2.1699999999999999 109.335 -175.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.512 ' HG2' ' HG3' ' A' ' 51' ' ' ARG . 4.3 mm-40 -80.17 -39.96 28.24 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.201 -1.363 . . . . 1.1000000000000001 109.715 -179.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.52 -41.57 75.85 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.581 -0.736 . . . . 0.53000000000000003 109.836 172.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.662 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.13 -31.96 74.65 Favored Glycine 0 C--O 1.222 -0.617 0 CA-C-N 115.533 -0.758 . . . . 0.69999999999999996 111.577 177.052 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -54.26 -39.16 66.6 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 122.591 0.356 . . . . 1.04 111.032 177.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.462 ' HA ' HD21 ' A' ' 59' ' ' LEU . 2.9 tt0 -79.66 -26.48 41.03 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.667 0.746 . . . . 2.29 110.574 179.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.412 ' CE1' ' HB2' ' A' ' 102' ' ' ALA . 10.4 m-85 -80.99 -18.41 47.0 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 116.084 -0.507 . . . . 2.29 112.269 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.662 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 40.1 mt-10 -66.95 -68.49 0.37 Allowed 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 120.603 0.24 . . . . 1.3 110.941 -177.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.611 HD23 ' H ' ' A' ' 59' ' ' LEU . 1.9 pt? -48.01 -38.78 17.89 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.529 -0.76 . . . . 1.54 111.242 178.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.514 ' N ' ' HG ' ' A' ' 59' ' ' LEU . 66.0 mtt180 -54.67 -53.79 50.16 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.041 -0.527 . . . . 2.5800000000000001 111.034 -177.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -85.25 -21.3 29.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.987 -0.551 . . . . 5.3200000000000003 110.678 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.783 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 43.5 ttm180 -56.16 -28.5 58.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.12 -0.491 . . . . 4.4800000000000004 110.889 179.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 63' ' ' ARG . 12.5 mmt180 -57.52 -55.6 32.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.77 -0.65 . . . . 4.7199999999999998 111.297 176.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.459 ' HB1' HD13 ' A' ' 68' ' ' LEU . . . -91.84 -32.78 15.2 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.996 0.739 . . . . 1.1699999999999999 112.996 -173.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.854 ' HA ' ' HB2' ' A' ' 68' ' ' LEU . 0.3 OUTLIER -61.07 -25.44 66.94 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.813 0.671 . . . . 2.8100000000000001 112.813 -166.566 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 15.4 m -63.66 -36.07 82.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.292 0.567 . . . . 2.1899999999999999 110.443 177.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -90.45 -32.41 16.41 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.493 -0.776 . . . . 2.7200000000000002 109.926 176.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.854 ' HB2' ' HA ' ' A' ' 65' ' ' PHE . 4.0 mp -64.67 -24.83 67.7 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 115.589 -0.732 . . . . 1.5600000000000001 112.465 -178.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.791 HG22 HG13 ' A' ' 74' ' ' ILE . 2.5 p -61.38 -26.07 67.59 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.498 -0.481 . . . . 0.69999999999999996 110.731 177.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 29.4 t -72.22 -39.35 68.59 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 109.248 -0.649 . . . . 1.3400000000000001 109.248 172.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.806 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 9.1 mt-30 -63.62 -52.53 60.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.535 -0.757 . . . . 1.4199999999999999 110.299 178.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.707 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mp -67.5 -31.33 71.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.465 -0.789 . . . . 1.3700000000000001 110.5 -179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 64.18 66.22 0.64 Allowed 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 121.567 0.699 . . . . 2.7200000000000002 109.464 -173.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.791 HG13 HG22 ' A' ' 69' ' ' THR . 25.3 mm -62.04 117.61 3.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.648 -1.16 . . . . 0.91000000000000003 110.426 178.341 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.745 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -159.57 -172.52 0.33 Allowed Pre-proline 0 C--N 1.316 -0.881 0 N-CA-C 107.723 -1.214 . . . . 0.51000000000000001 107.723 -169.481 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.745 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 38.2 Cg_exo -29.79 166.32 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.959 3.773 . . . . 0.46999999999999997 114.996 164.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.449 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.03 -29.3 0.01 OUTLIER Glycine 0 N--CA 1.475 1.279 0 N-CA-C 117.211 1.644 . . . . 0.40000000000000002 117.211 -175.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.448 ' N ' ' O ' ' A' ' 76' ' ' PRO . 23.9 p -67.71 1.23 2.6 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 117.949 0.874 . . . . 0.56000000000000005 112.358 178.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.401 ' HB2' ' H ' ' A' ' 75' ' ' THR . . . -72.3 -13.93 61.62 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.101 0.476 . . . . 0.34000000000000002 110.125 171.343 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.441 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 53.5 t80 -75.28 -22.41 57.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.892 -0.595 . . . . 4.1299999999999999 109.581 175.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -82.7 -27.53 31.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.745 0.783 . . . . 1.03 109.608 174.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.496 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 6.5 m -69.91 -52.48 24.27 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 114.627 -1.17 . . . . 0.47999999999999998 109.515 172.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -66.47 -23.19 66.23 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 115.098 -0.955 . . . . 1.1799999999999999 110.088 178.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.526 ' HA ' HG23 ' A' ' 87' ' ' VAL . 30.1 tt0 -55.45 -48.7 74.08 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.159 0.504 . . . . 0.80000000000000004 110.739 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.537 ' OE1' HG21 ' B' 1004 ' ' VAL . 86.3 mt-30 -47.12 -29.78 2.44 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.528 -1.214 . . . . 1.6200000000000001 111.748 176.119 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.673 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.0 t -90.35 -49.77 13.42 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.131 0 CA-C-N 115.121 -0.945 . . . . 1.3 110.199 -173.316 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.526 HG23 ' HA ' ' A' ' 84' ' ' GLU . 0.2 OUTLIER -52.45 -38.69 26.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 122.689 1.233 . . . . 0.84999999999999998 108.878 177.129 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.452 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 4.4 m-80 -62.65 -43.89 97.65 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 112.652 -2.067 . . . . 0.91000000000000003 112.16 -177.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 1.034 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.3 pp20? -67.71 -34.51 77.02 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-O 122.092 0.949 . . . . 2.8700000000000001 108.967 177.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.612 HD13 ' OE2' ' A' ' 89' ' ' GLU . 0.3 OUTLIER -66.9 -24.9 66.16 Favored 'General case' 0 N--CA 1.433 -1.305 0 CA-C-N 113.135 -1.848 . . . . 1.28 111.399 -165.729 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.783 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 4.7 p90 -108.49 -35.56 6.45 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 120.329 -0.548 . . . . 2.2999999999999998 111.912 -172.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.452 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 10.3 ptm180 -75.31 -35.21 61.27 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.685 0.755 . . . . 5.0599999999999996 110.675 -171.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.428 ' HB3' HH12 ' A' ' 99' ' ' ARG . 13.6 t70 -87.59 4.27 44.38 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.827 -1.079 . . . . 3.1200000000000001 112.412 -169.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 129.67 70.13 0.12 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 117.375 -2.345 . . . . 2.3100000000000001 115.505 179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.783 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 64.5 t -69.94 99.22 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-O 122.613 1.197 . . . . 1.0600000000000001 110.93 -179.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.733 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 0.2 OUTLIER -107.45 -179.03 3.8 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 113.402 -1.726 . . . . 2.1200000000000001 107.726 168.033 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.61 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 15.2 m-90 -49.7 -40.87 41.83 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 123.36 0.412 . . . . 3.3399999999999999 111.569 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.553 ' HA3' HG21 ' B' 1015 ' ' ILE . . . -64.76 -41.01 97.8 Favored Glycine 0 CA--C 1.524 0.599 0 N-CA-C 114.574 0.59 . . . . 0.68999999999999995 114.574 -175.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.733 ' HG2' ' ND2' ' A' ' 96' ' ' ASN . 13.9 mmt85 -58.79 -43.27 90.42 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.21 0.529 . . . . 4.2400000000000002 111.123 -175.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 70.3 mt -68.89 -41.0 81.87 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.533 -0.758 . . . . 0.44 110.622 -176.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 97' ' ' TRP . 63.0 t -54.45 -54.58 20.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.024 -0.535 . . . . 1.3500000000000001 109.856 171.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.412 ' HB2' ' CE1' ' A' ' 57' ' ' PHE . . . -52.33 -45.78 65.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.015 -0.993 . . . . 0.44 111.384 177.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.618 ' HZ ' ' HA ' ' A' ' 130' ' ' MET . 42.5 t80 -55.21 -39.63 69.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.553 -0.749 . . . . 1.49 111.25 178.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 1.004 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 27.0 m-85 -78.47 -35.69 46.3 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.683 0.278 . . . . 3.29 111.116 177.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.74 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 23.1 m -63.69 -47.47 81.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.241 -0.436 . . . . 1.1899999999999999 110.658 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.437 ' HE1' ' HB2' ' A' ' 65' ' ' PHE . 50.1 t80 -81.74 -29.29 32.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.022 -0.536 . . . . 2.8900000000000001 110.618 -178.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -67.46 -47.72 61.3 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.769 -0.729 . . . . 0.29999999999999999 111.285 175.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.952 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -64.92 -28.59 73.66 Favored Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 111.466 -0.654 . . . . 0.23000000000000001 111.466 176.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.1 -32.75 61.51 Favored 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 110.295 -0.261 . . . . 0.31 110.295 176.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.402 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -68.29 -36.25 79.08 Favored 'General case' 0 CA--C 1.507 -0.679 0 CA-C-O 121.896 0.855 . . . . 1.1200000000000001 109.494 -179.01 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.702 ' SG ' HG13 ' A' ' 123' ' ' VAL . 24.5 t -49.34 -50.88 37.8 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 113.77 -1.559 . . . . 0.26000000000000001 109.579 171.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.526 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 96.4 t -67.27 -34.43 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 CA-C-N 115.634 -0.712 . . . . 0.34999999999999998 110.945 177.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.624 ' HB3' HG21 ' A' ' 74' ' ' ILE . 7.8 mm-40 -59.87 -28.98 68.0 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 121.388 0.614 . . . . 2.5099999999999998 110.5 177.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.511 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 18.3 m -78.89 -39.61 34.53 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.347 -0.842 . . . . 0.28000000000000003 109.082 177.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.648 HG23 ' O ' ' A' ' 111' ' ' CYS . 96.4 t -67.37 -34.66 70.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 121.985 0.898 . . . . 1.23 109.634 -177.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -54.78 -50.79 67.62 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.584 -1.644 . . . . 0.59999999999999998 111.25 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 24.6 mmtt -86.33 12.75 9.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.717 -0.674 . . . . 1.6200000000000001 110.055 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.39 52.07 4.98 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.87 0.843 . . . . 1.8799999999999999 110.971 -178.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.558 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 25.9 mtm -125.74 44.52 2.81 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.394 -1.276 . . . . 0.31 107.883 178.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.46 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 5.8 mt-30 -60.02 -8.13 2.17 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.763 1.023 . . . . 1.1499999999999999 113.763 -173.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.505 HG23 HD22 ' A' ' 122' ' ' LEU . 27.1 m -66.81 -24.5 32.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 O-C-N 122.008 -0.432 . . . . 0.46000000000000002 110.904 175.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.789 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -71.3 -26.85 63.04 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 116.434 -0.348 . . . . 0.26000000000000001 110.338 179.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.702 HG13 ' SG ' ' A' ' 111' ' ' CYS . 69.1 t -46.86 -54.64 2.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 123.576 0.548 . . . . 0.25 111.64 178.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.581 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 2.5 t -70.79 -29.57 65.81 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.738 0.304 . . . . 1.3500000000000001 110.757 -179.161 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.789 ' HD2' HD13 ' A' ' 122' ' ' LEU . 73.8 mtt180 -69.31 -54.37 14.93 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.029 0.442 . . . . 2.6699999999999999 110.436 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.595 HG22 ' SD ' ' A' ' 130' ' ' MET . 73.0 mt -56.01 -52.02 54.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.618 -0.719 . . . . 0.23000000000000001 110.451 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.816 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.02 -33.73 69.27 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 120.889 0.376 . . . . 0.28999999999999998 111.599 -179.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.561 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -62.21 -62.31 1.86 Allowed 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 121.124 0.488 . . . . 0.28000000000000003 110.379 176.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -62.07 -32.95 73.54 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.05 -0.977 . . . . 3.9100000000000001 111.617 -175.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.618 ' HA ' ' HZ ' ' A' ' 103' ' ' PHE . 88.9 mtp -61.63 -53.57 54.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.981 0.419 . . . . 1.0800000000000001 110.837 178.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.523 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -63.82 -39.07 93.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.046 -0.524 . . . . 0.25 110.982 179.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 86.3 m -63.66 -47.49 81.06 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.454 -0.339 . . . . 0.40000000000000002 111.074 178.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.425 ' CE2' HG12 ' A' ' 87' ' ' VAL . 52.2 t80 -57.21 -39.69 75.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.506 -0.315 . . . . 3.1299999999999999 110.403 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 1.004 HD12 ' HZ ' ' A' ' 104' ' ' PHE . 4.8 tt -58.32 -54.26 49.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.365 -0.976 . . . . 0.94999999999999996 108.365 172.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -52.73 -46.31 67.35 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.229 -0.896 . . . . 0.46000000000000002 112.194 -177.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -80.13 -59.19 2.81 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.319 0.58 . . . . 0.58999999999999997 111.509 -176.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -92.62 -47.44 7.1 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 113.354 0.872 . . . . 1.45 113.354 -168.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.968 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -80.25 -43.35 21.52 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 113.502 0.927 . . . . 1.2 113.502 -166.636 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.665 ' HA ' HD12 ' A' ' 142' ' ' ILE . 32.9 tt0 -45.27 -53.11 18.65 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 112.919 0.711 . . . . 0.75 112.919 -175.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.54 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 19.6 Cg_endo -58.62 -45.29 30.66 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 121.693 1.595 . . . . 0.56000000000000005 111.718 178.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -61.5 -42.58 99.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.419 -0.809 . . . . 1.2 110.547 178.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.665 HD12 ' HA ' ' A' ' 139' ' ' GLU . 28.1 mt -52.11 -49.16 40.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.876 -0.602 . . . . 0.32000000000000001 110.83 174.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.621 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 71.1 mm-40 -63.06 -25.86 68.57 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.547 -0.751 . . . . 0.56999999999999995 111.324 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.54 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.6 mm-40 -68.15 -22.27 64.86 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.447 0.641 . . . . 0.78000000000000003 110.0 174.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.607 ' N ' HD22 ' A' ' 145' ' ' ASN . 0.7 OUTLIER -105.03 4.08 31.22 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.149 -0.932 . . . . 0.93000000000000005 109.785 -174.906 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 111.41 -43.28 1.75 Allowed Glycine 0 N--CA 1.442 -0.935 0 CA-C-N 115.385 -0.825 . . . . 0.56000000000000005 112.437 177.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.58 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 128.6 -176.88 18.08 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.368 -0.92 . . . . 0.48999999999999999 112.808 178.284 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.631 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 8.5 m-90 -70.76 -38.48 73.46 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 122.683 0.393 . . . . 3.5699999999999998 110.843 -178.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -61.35 -45.05 96.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.938 0.399 . . . . 1.96 110.197 178.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.545 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 93.4 m -59.13 -35.41 73.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.853 -0.612 . . . . 0.67000000000000004 111.477 178.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.61 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 88.4 t80 -60.96 -42.01 97.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.802 0.335 . . . . 3.0 110.509 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.475 HG21 ' HB1' ' A' ' 45' ' ' ALA . 1.6 m -71.59 -25.09 24.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 1.1499999999999999 110.27 179.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.487 ' HB2' ' O ' ' A' ' 150' ' ' THR . 19.2 mm-40 -62.19 -30.36 71.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.88 0.371 . . . . 1.6699999999999999 110.33 171.409 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.7 mt -90.52 -62.05 1.54 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.135 -0.484 . . . . 1.3 110.941 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -123.64 29.65 6.5 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.451 0.643 . . . . 4.2400000000000002 110.721 -175.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.54 ' HA2' ' CB ' ' A' ' 49' ' ' ALA . . . -58.16 165.81 7.03 Favored Glycine 0 CA--C 1.499 -0.917 0 CA-C-N 115.474 -0.785 . . . . 1.1000000000000001 113.759 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.486 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 27.4 t-20 -64.38 109.77 2.03 Favored 'General case' 0 C--N 1.307 -1.26 0 CA-C-N 113.888 -1.156 . . . . 1.29 110.837 178.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.699 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 9.5 m120 -82.71 -21.23 34.88 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.068 -0.514 . . . . 2.9900000000000002 111.058 -178.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -54.42 -47.66 72.56 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.491 0.494 . . . . 2.52 110.829 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -81.15 -35.74 31.11 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.105 -0.498 . . . . 2.8700000000000001 110.714 176.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.612 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -54.29 -59.81 4.17 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.08 -0.509 . . . . 3.2000000000000002 111.628 -178.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.699 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 8.0 pt-20 -58.84 -33.89 70.93 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.622 0.249 . . . . 3.7200000000000002 111.417 178.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 72.0 m -66.14 -36.17 82.43 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.933 0.397 . . . . 4.1799999999999997 110.676 -178.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 26.7 mmm180 -80.14 -28.05 38.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.655 0.74 . . . . 5.8200000000000003 109.822 175.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -74.33 -19.17 60.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.657 -1.156 . . . . 4.7699999999999996 110.872 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -61.79 -37.5 94.41 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 121.066 -0.588 . . . . 5.0999999999999996 112.491 -177.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -82.36 -23.89 34.79 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.29 0.566 . . . . 5.7199999999999998 110.148 176.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -74.01 -8.41 56.03 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.714 -0.675 . . . . 5.8799999999999999 110.185 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.549 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 0.4 OUTLIER -73.3 -38.31 65.91 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.608 -0.886 . . . . 7.3399999999999999 108.608 176.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.499 HD22 ' HB3' ' A' ' 169' ' ' ARG . 2.8 mm? -95.65 -18.0 20.87 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.361 -0.836 . . . . 6.9699999999999998 109.931 -179.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 65.76 179.5 0.2 Allowed 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.319 -0.855 . . . . 6.9699999999999998 111.349 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 7.7 p80 -130.17 86.49 2.4 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 108.533 -0.914 . . . . 9.3499999999999996 108.533 171.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -85.68 134.3 33.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.717 -1.129 . . . . 11.4 111.732 -169.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -95.96 164.1 12.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.584 -0.735 . . . . 11.52 109.306 175.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 20.5 t-80 -95.08 86.63 4.66 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.079 0.466 . . . . 14.48 110.066 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 33.7 t-80 -94.27 -40.22 10.1 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.28 -0.637 . . . . 15.369999999999999 109.28 177.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -69.23 150.33 47.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.638 -0.71 . . . . 16.02 109.344 173.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 6.4 mp -91.98 160.19 15.37 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.786 0.327 . . . . 17.989999999999998 110.407 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -76.17 -21.05 56.98 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.358 0.599 . . . . 19.190000000000001 109.487 177.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 22.5 p80 -122.62 117.37 25.67 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.223 -0.899 . . . . 22.260000000000002 108.908 173.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -135.95 24.06 3.32 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.481 -0.327 . . . . 22.510000000000002 111.658 -177.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 46.7 m80 -74.6 86.93 2.13 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.282 -0.636 . . . . 24.890000000000001 109.282 172.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 32.7 t-80 -76.05 -24.55 55.17 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.092 -0.503 . . . . 25.579999999999998 110.383 -176.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 47.9 t-80 56.34 81.49 0.13 Allowed 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.68 -0.691 . . . . 27.370000000000001 109.87 -177.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.134 -0.936 . . . . 29.059999999999999 109.843 -175.194 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.257 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -117.41 26.72 8.0 Favored Glycine 0 N--CA 1.448 -0.555 0 O-C-N 121.472 -0.768 . . . . 2.9700000000000002 112.422 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.624 ' HB3' ' HE ' ' B' 1006 ' ' ARG . 68.9 m -106.06 86.35 2.36 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.008 0.432 . . . . 1.9399999999999999 111.416 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.942 HG23 ' H ' ' B' 1005 ' ' GLY . 5.8 m -134.92 -77.94 0.12 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.367 0 CA-C-N 115.983 -0.553 . . . . 1.6299999999999999 110.153 167.038 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 0.942 ' H ' HG23 ' B' 1004 ' ' VAL . . . -61.07 58.97 0.01 OUTLIER Glycine 0 CA--C 1.526 0.721 0 C-N-CA 121.265 -0.493 . . . . 1.2 113.293 169.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . 0.883 ' HG3' ' C1 ' ' B' 1100 ' ' 33B . 0.0 OUTLIER -145.79 -29.56 0.42 Allowed 'General case' 0 C--O 1.215 -0.746 0 C-N-CA 122.787 0.435 . . . . 2.8799999999999999 110.344 175.888 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . 0.833 ' H ' ' HD3' ' B' 1006 ' ' ARG . . . -120.33 -27.3 5.26 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-N 115.984 -0.553 . . . . 1.3100000000000001 110.708 -176.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.422 ' HG ' HG13 ' A' ' 86' ' ' VAL . 2.7 mm? -61.02 -46.77 89.39 Favored 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 106.069 -1.826 . . . . 1.3300000000000001 106.069 165.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 1.034 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -53.97 -56.9 13.53 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 113.629 -1.623 . . . . 0.88 111.832 167.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.775 ' HB3' ' HA ' ' B' 1007 ' ' ALA . . . -67.44 -54.33 21.2 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.165 -0.925 . . . . 1.03 112.908 -171.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.775 ' HE1' ' N10' ' B' 1100 ' ' 33B . 5.7 m-30 -66.0 -26.69 67.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.311 -0.404 . . . . 1.6699999999999999 110.131 -176.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -87.5 1.01 85.64 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.662 -0.699 . . . . 0.78000000000000003 113.458 -176.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 4.1 t70 -89.48 -3.21 58.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.162 0.506 . . . . 1.8999999999999999 110.246 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 3.2 m -93.74 92.22 7.38 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.949 -0.568 . . . . 1.4399999999999999 110.357 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.553 HG21 ' HA3' ' A' ' 98' ' ' GLY . 1.3 pp -140.83 37.62 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 112.059 0.392 . . . . 2.9100000000000001 112.059 -178.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -109.28 104.65 13.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.255 -0.43 . . . . 4.29 110.032 176.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -114.54 98.16 6.72 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.818 -0.628 . . . . 8.1699999999999999 110.272 -178.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.566 0 CA-C-N 116.485 -0.325 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.883 ' C1 ' ' HG3' ' B' 1006 ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.9 ptp . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 120.503 0.192 . . . . 6.21 111.187 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.7 m -100.04 137.98 37.74 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.773 0.32 . . . . 1.8700000000000001 110.746 -176.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.1 mp0 -101.51 -8.85 21.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.349 0.595 . . . . 2.4199999999999999 109.601 175.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.518 ' O ' HD13 ' A' ' 8' ' ' LEU . 1.5 p -68.66 -22.71 64.37 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.509 -0.769 . . . . 1.25 111.554 -178.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.517 ' HB3' HD22 ' A' ' 134' ' ' LEU . 3.1 p30 -62.72 -24.17 67.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.103 -0.499 . . . . 1.78 110.404 175.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.534 ' O ' HG23 ' A' ' 10' ' ' VAL . 3.9 tpp180 -61.53 -44.64 96.69 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.766 -0.652 . . . . 1.3999999999999999 109.832 174.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.435 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 42.6 mt-10 -56.1 -57.85 10.4 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 115.554 -0.748 . . . . 0.68000000000000005 110.166 179.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.518 HD13 ' O ' ' A' ' 4' ' ' SER . 5.8 mp -41.53 -50.25 4.01 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.647 -1.161 . . . . 1.1599999999999999 111.098 178.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.472 HG21 ' N ' ' A' ' 131' ' ' ALA . 79.0 t -64.66 -59.5 4.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.51 -0.313 . . . . 0.27000000000000002 111.04 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 6' ' ' ARG . 85.4 t -54.13 -48.14 65.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.135 -0.484 . . . . 0.33000000000000002 112.122 -175.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -51.09 -43.83 61.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.93 -0.577 . . . . 0.58999999999999997 110.808 -177.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.642 ' HB2' ' CE2' ' A' ' 104' ' ' PHE . 6.1 t80 -81.59 -41.34 21.69 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 116.19 -0.459 . . . . 1.6100000000000001 111.679 -175.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 1.028 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 3.8 mp -60.46 -40.21 90.39 Favored 'General case' 0 CA--C 1.52 -0.208 0 C-N-CA 119.771 -0.772 . . . . 0.34000000000000002 109.745 178.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.495 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 48.5 t -64.07 -46.5 84.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.673 -0.694 . . . . 1.05 110.067 175.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -60.36 -32.22 71.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.518 -0.764 . . . . 1.22 110.9 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.704 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 6.4 mmpt? -75.61 -33.19 60.51 Favored 'General case' 0 N--CA 1.446 -0.665 0 N-CA-C 111.839 0.311 . . . . 1.4099999999999999 111.839 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.606 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -62.22 -27.72 69.19 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 119.736 -0.786 . . . . 1.3500000000000001 109.788 175.163 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.9 t -65.61 -30.33 71.04 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.379 -0.828 . . . . 0.93999999999999995 112.219 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.704 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 13.4 pt20 -74.92 -9.24 58.36 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.773 0.657 . . . . 1.3700000000000001 112.773 -172.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.785 ' NZ ' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -119.24 -19.94 8.14 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 121.918 0.866 . . . . 2.2000000000000002 109.549 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.51 26.4 6.89 Favored Glycine 0 C--N 1.306 -1.086 0 CA-C-N 113.945 -1.48 . . . . 0.53000000000000003 113.058 173.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -104.98 171.23 7.43 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.612 0.244 . . . . 0.76000000000000001 110.555 170.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.6 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 8.3 t -110.67 157.63 19.51 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.104 0.478 . . . . 0.52000000000000002 110.861 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.534 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 65.6 t-105 -75.92 -52.05 11.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.516 -0.766 . . . . 3.3599999999999999 110.172 174.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.3 m -67.21 -19.91 65.62 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.579 -0.737 . . . . 1.3700000000000001 111.685 -174.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.6 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 51.3 mt-30 -51.93 -38.7 57.36 Favored 'General case' 0 N--CA 1.461 0.092 0 N-CA-C 111.793 0.294 . . . . 1.1100000000000001 111.793 177.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -121.93 -4.15 9.11 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.831 0.678 . . . . 1.28 112.831 -178.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.638 ' HB3' HG22 ' A' ' 30' ' ' VAL . 19.8 m -102.16 149.23 24.49 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 122.026 0.917 . . . . 1.8100000000000001 112.094 -178.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -124.37 -1.71 8.09 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 113.594 -1.639 . . . . 2.3100000000000001 109.015 -179.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.863 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.6 m -58.75 -73.7 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 113.889 -1.505 . . . . 0.92000000000000004 112.801 -168.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.863 ' H ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -90.73 0.06 57.54 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.481 0.658 . . . . 2.7400000000000002 109.868 177.262 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -72.56 -44.92 61.45 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 114.774 -1.103 . . . . 1.45 110.857 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -103.03 -31.59 10.12 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.961 -0.563 . . . . 1.8700000000000001 111.435 -174.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.606 ' O ' ' HA ' ' A' ' 31' ' ' GLU . 51.3 ptt85 -137.22 155.13 49.89 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.327 -0.397 . . . . 3.3900000000000001 110.322 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 18.9 p -137.43 112.54 9.11 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.304 0.574 . . . . 2.25 111.175 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -80.52 -72.15 0.43 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.603 -0.726 . . . . 3.3399999999999999 110.19 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -95.42 148.07 34.03 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.717 -0.674 . . . . 1.9199999999999999 109.823 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.518 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 71.5 Cg_exo -51.39 163.35 1.08 Allowed 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 123.317 2.678 . . . . 1.8700000000000001 112.574 174.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -70.01 -2.8 13.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.402 -0.363 . . . . 4.6399999999999997 111.841 -178.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 175.54 63.65 0.06 OUTLIER Glycine 0 N--CA 1.443 -0.853 0 C-N-CA 120.833 -0.699 . . . . 2.1499999999999999 111.967 175.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.699 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -75.8 -75.51 0.18 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.424 -0.51 . . . . 1.1200000000000001 110.28 -177.729 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.699 ' H ' HG23 ' A' ' 41' ' ' THR . 14.3 pt-20 -93.85 -31.24 14.42 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 122.011 0.91 . . . . 2.02 109.892 173.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.747 ' HA ' HG13 ' A' ' 46' ' ' VAL . 57.7 m -63.66 -25.11 68.07 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 113.653 -1.612 . . . . 1.25 113.261 -170.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -40.12 -50.8 2.65 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 123.613 0.571 . . . . 1.9099999999999999 112.314 -173.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.82 -40.05 41.75 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.931 -0.308 . . . . 0.52000000000000002 111.652 176.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.747 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.9 m -65.12 -46.13 92.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 121.284 -0.166 . . . . 1.4099999999999999 111.381 -176.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.744 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.8 ptpt -68.34 -40.27 81.64 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.457 -0.571 . . . . 0.67000000000000004 109.457 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.7 HE21 ' HA ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -58.34 -38.4 77.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.414 -0.812 . . . . 0.98999999999999999 111.086 174.882 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.5 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -72.06 -41.57 67.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.4 0.619 . . . . 0.41999999999999998 110.981 176.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.546 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.1 tp -65.98 -24.83 66.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.318 -0.856 . . . . 1.3300000000000001 112.087 -174.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.616 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 7.6 ptp180 -85.63 -25.91 26.34 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 121.705 0.764 . . . . 2.1699999999999999 109.491 -177.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.821 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 7.5 mm-40 -69.57 -47.54 63.26 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.705 -1.134 . . . . 1.1000000000000001 109.282 173.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' A' ' 56' ' ' GLU . . . -66.81 -33.19 75.07 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.084 -0.962 . . . . 0.53000000000000003 110.173 174.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.655 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -59.06 -46.44 93.74 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.371 -0.692 . . . . 0.69999999999999996 111.371 176.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.652 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 30.4 t70 -63.26 -37.29 86.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.963 0.411 . . . . 1.04 110.283 176.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.485 ' O ' HD11 ' A' ' 59' ' ' LEU . 14.6 tp10 -60.48 -28.15 68.12 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.34 -0.845 . . . . 2.29 110.469 176.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.693 ' HZ ' ' HB3' ' B' 1008 ' ' LEU . 49.8 t80 -81.9 -46.56 13.9 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.322 -0.854 . . . . 2.29 110.771 174.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.747 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 46.3 mt-10 -60.13 -57.67 11.8 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.504 -0.771 . . . . 1.3 112.76 -170.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.705 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -43.32 -41.47 4.06 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.853 1.057 . . . . 1.54 113.853 -172.851 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.705 ' H ' HD12 ' A' ' 59' ' ' LEU . 72.5 mtt85 -67.81 -45.71 73.96 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.011 0.374 . . . . 2.5800000000000001 112.011 -175.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.747 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 5.0 p90 -92.42 -3.87 54.59 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.731 -0.213 . . . . 5.3200000000000003 111.159 -179.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.9 tpp180 -43.36 -49.52 6.94 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.361 0.664 . . . . 4.4800000000000004 112.578 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -67.21 -13.51 62.03 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.209 0.448 . . . . 4.7199999999999998 112.209 -175.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.487 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -92.14 -26.6 18.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 111.842 0.312 . . . . 1.1699999999999999 111.842 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.613 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 81.3 t80 -48.96 -46.45 43.48 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.078 0.77 . . . . 2.8100000000000001 113.078 -170.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 32.8 t -68.03 -40.14 82.96 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.913 0.387 . . . . 2.1899999999999999 110.896 -175.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -71.2 -39.45 71.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.049 -0.523 . . . . 2.7200000000000002 111.006 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.487 HD13 ' O ' ' A' ' 64' ' ' ALA . 3.7 mp -64.81 -20.46 66.4 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 113.211 0.819 . . . . 1.5600000000000001 113.211 -171.121 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.528 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 3.2 p -57.45 -35.49 70.19 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.064 0.847 . . . . 0.69999999999999996 111.16 -179.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.0 t -71.93 -25.36 61.86 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.54 -0.754 . . . . 1.3400000000000001 109.528 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.48 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 9.2 mt-30 -83.82 -38.01 21.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.223 -0.898 . . . . 1.4199999999999999 110.133 -178.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.583 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.8 mm? -65.96 -32.99 74.8 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.734 -0.469 . . . . 1.3700000000000001 109.734 170.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.433 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 50.6 m80 68.16 41.77 1.89 Allowed 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 108.144 -1.058 . . . . 2.7200000000000002 108.144 -173.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.583 HG12 ' HB2' ' A' ' 72' ' ' LEU . 28.0 mm -50.44 117.15 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 CA-C-N 113.322 -1.763 . . . . 0.91000000000000003 111.931 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.761 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.46 -171.48 0.28 Allowed Pre-proline 0 N--CA 1.441 -0.913 0 N-CA-C 107.43 -1.322 . . . . 0.51000000000000001 107.43 -173.097 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.761 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.7 Cg_exo -28.86 166.83 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 125.017 3.811 . . . . 0.46999999999999997 115.355 164.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.527 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -29.09 -28.75 0.01 OUTLIER Glycine 0 N--CA 1.472 1.074 0 N-CA-C 117.937 1.935 . . . . 0.40000000000000002 117.937 -170.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.471 ' N ' ' O ' ' A' ' 76' ' ' PRO . 41.7 p -66.72 5.8 0.57 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 118.31 1.055 . . . . 0.56000000000000005 112.339 -178.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.9 -12.43 61.61 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 120.975 0.417 . . . . 0.34000000000000002 110.096 174.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.527 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 10.4 p90 -76.33 -17.3 59.49 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 121.427 0.632 . . . . 4.1299999999999999 109.349 174.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.436 ' HB2' ' O ' ' A' ' 78' ' ' THR . 35.7 mt-30 -84.91 -20.02 31.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.101 -0.954 . . . . 1.03 109.698 174.015 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.0 m -82.04 -53.28 6.25 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.531 -1.213 . . . . 0.47999999999999998 109.667 173.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.551 ' HA ' HG23 ' A' ' 86' ' ' VAL . 78.3 t80 -63.09 -16.68 60.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.326 -0.852 . . . . 1.1799999999999999 110.111 174.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.526 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.3 tt0 -54.68 -50.23 68.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.205 -0.907 . . . . 0.80000000000000004 110.374 173.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -49.94 -32.15 14.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.986 -1.006 . . . . 1.6200000000000001 110.888 177.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.883 HG13 HD12 ' B' 1008 ' ' LEU . 1.8 t -80.93 -53.49 12.31 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 CA-C-N 114.733 -1.121 . . . . 1.3 110.443 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.526 HG12 ' HA ' ' A' ' 84' ' ' GLU . 8.9 p -60.98 -23.55 30.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.815 0.817 . . . . 0.84999999999999998 109.337 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.6 m-80 -78.06 -38.87 43.39 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.338 -1.301 . . . . 0.91000000000000003 112.089 176.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 1.114 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.0 OUTLIER -73.84 -32.38 63.65 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.343 -0.984 . . . . 2.8700000000000001 108.343 178.805 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.676 HD13 ' OE1' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -67.61 -44.02 79.06 Favored 'General case' 0 N--CA 1.435 -1.191 0 CA-C-N 114.553 -1.203 . . . . 1.28 110.233 -174.059 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.407 ' CD1' ' HA ' ' A' ' 88' ' ' ASN . 0.4 OUTLIER -99.14 10.18 41.96 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.496 -0.774 . . . . 2.2999999999999998 111.066 -169.802 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.862 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.09 -23.47 66.54 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.108 -0.496 . . . . 5.0599999999999996 110.542 178.301 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -96.44 -31.11 12.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 122.068 0.937 . . . . 3.1200000000000001 109.186 169.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.59 ' O ' HG23 ' A' ' 95' ' ' VAL . . . 130.79 -42.1 1.44 Allowed Glycine 0 C--N 1.312 -0.79 0 CA-C-N 113.862 -1.517 . . . . 2.3100000000000001 113.234 165.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.649 HG21 HD22 ' A' ' 138' ' ' LEU . 1.6 t 168.2 131.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 C-N-CA 125.079 1.352 . . . . 1.0600000000000001 110.582 157.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.643 ' H ' ' CB ' ' A' ' 99' ' ' ARG . 2.0 m120 -111.16 170.07 8.35 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.387 -0.824 . . . . 2.1200000000000001 109.313 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.554 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 16.9 m-90 -54.76 -58.05 9.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.933 0.396 . . . . 3.3399999999999999 110.713 175.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.564 ' HA3' ' HB ' ' B' 1015 ' ' ILE . . . -70.2 -13.94 70.79 Favored Glycine 0 CA--C 1.518 0.272 0 CA-C-N 115.93 -0.577 . . . . 0.68999999999999995 112.689 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.643 ' CB ' ' H ' ' A' ' 96' ' ' ASN . 18.2 tpp180 -69.35 -43.2 74.1 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.078 0.466 . . . . 4.2400000000000002 110.97 -176.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 90.2 mt -64.67 -40.26 88.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.731 -0.668 . . . . 0.44 110.547 -178.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.551 ' O ' ' HD1' ' A' ' 104' ' ' PHE . 0.5 OUTLIER -63.97 -38.19 81.76 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 CA-C-N 116.204 -0.453 . . . . 1.3500000000000001 110.322 175.592 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.1 -46.44 89.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.354 0.597 . . . . 0.44 110.217 176.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -58.22 -50.0 75.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.81 -1.087 . . . . 1.49 111.284 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.642 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -76.49 -20.04 57.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.808 0.337 . . . . 3.29 110.948 -176.32 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.617 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 37.3 t -75.67 -55.98 5.13 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.261 -0.427 . . . . 1.1899999999999999 110.304 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.431 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 31.4 t80 -66.49 -26.66 67.28 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 109.448 -0.575 . . . . 2.8900000000000001 109.448 179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.57 ' HA3' ' HE1' ' A' ' 130' ' ' MET . . . -65.11 -38.53 95.42 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 121.09 -0.576 . . . . 0.29999999999999999 111.735 174.036 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 1.028 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -68.77 -35.4 79.93 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.587 -0.816 . . . . 0.23000000000000001 111.076 174.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.613 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -67.81 -33.3 74.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.366 -0.417 . . . . 0.31 110.627 176.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.447 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -60.93 -37.42 82.25 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 122.221 1.01 . . . . 1.1200000000000001 108.708 -178.854 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.66 ' HB2' HD23 ' A' ' 13' ' ' LEU . 35.3 t -58.69 -53.74 54.98 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 114.038 -1.437 . . . . 0.26000000000000001 110.148 174.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.785 HG13 ' NZ ' ' A' ' 20' ' ' LYS . 80.7 t -60.18 -40.79 84.59 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.258 0 CA-C-N 116.619 -0.264 . . . . 0.34999999999999998 110.914 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.528 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 35.6 mt-10 -54.45 -38.22 66.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.011 0.434 . . . . 2.5099999999999998 110.611 176.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 48.0 m -74.38 -38.78 63.06 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.491 0.663 . . . . 0.28000000000000003 109.543 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.646 ' HA ' ' HG2' ' A' ' 120' ' ' GLN . 92.0 t -69.31 -30.31 45.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-N 115.114 -0.948 . . . . 1.23 109.783 -177.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -56.81 -49.79 74.32 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 113.641 -1.618 . . . . 0.59999999999999998 111.027 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 25.8 mmtt -87.4 11.96 13.27 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.439 -0.801 . . . . 1.6200000000000001 110.278 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 61.32 50.9 4.49 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 122.044 0.926 . . . . 1.8799999999999999 110.556 -178.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.608 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 24.3 mtm -125.63 46.91 2.3 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 114.255 -1.339 . . . . 0.31 107.565 176.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.646 ' HG2' ' HA ' ' A' ' 115' ' ' VAL . 27.8 mt-30 -68.44 -5.79 21.19 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.083 -0.962 . . . . 1.1499999999999999 111.142 -172.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.636 HG23 HD22 ' A' ' 122' ' ' LEU . 25.8 m -58.02 -24.65 24.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 122.142 -0.349 . . . . 0.46000000000000002 110.895 172.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.704 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.0 mm? -76.06 -26.8 56.9 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.481 -0.327 . . . . 0.26000000000000001 110.391 178.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.615 HG22 ' SG ' ' A' ' 111' ' ' CYS . 78.8 t -45.63 -57.62 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 O-C-N 123.806 0.691 . . . . 0.25 111.707 -179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -21.45 57.62 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.787 -0.642 . . . . 1.3500000000000001 111.639 -176.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.704 ' HD2' HD13 ' A' ' 122' ' ' LEU . 86.7 mtt180 -72.35 -58.22 3.57 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.924 -0.58 . . . . 2.6699999999999999 110.385 175.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.636 ' HA ' ' CE2' ' A' ' 129' ' ' TRP . 86.9 mt -48.25 -49.41 12.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.426 -0.806 . . . . 0.23000000000000001 111.595 -176.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.534 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -59.64 -26.3 65.39 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.09 0.404 . . . . 0.28999999999999998 112.09 -177.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.18 -65.13 0.71 Allowed 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 121.496 0.665 . . . . 0.28000000000000003 110.046 -178.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.636 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 38.7 p-90 -75.16 -17.85 60.31 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.04 -0.982 . . . . 3.9100000000000001 111.747 -175.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.57 ' HE1' ' HA3' ' A' ' 107' ' ' GLY . 13.3 mmm -62.21 -57.67 10.59 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 120.967 0.413 . . . . 1.0800000000000001 110.248 170.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.472 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -64.0 -38.29 90.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.883 -0.598 . . . . 0.25 110.538 179.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.516 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 89.1 m -60.78 -43.56 97.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.399 -0.364 . . . . 0.40000000000000002 111.534 176.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.7 t80 -60.88 -39.9 90.99 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.775 -0.454 . . . . 3.1299999999999999 109.775 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.517 HD22 ' HB3' ' A' ' 5' ' ' ASN . 5.4 tt -62.18 -50.87 70.1 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.603 -0.888 . . . . 0.94999999999999996 108.603 173.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -48.69 -56.74 7.69 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.977 -0.556 . . . . 0.46000000000000002 112.41 179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -78.06 -49.74 13.4 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.043 0.449 . . . . 0.58999999999999997 111.88 -174.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -91.3 -50.81 5.61 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 112.788 0.662 . . . . 1.45 112.788 -169.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.649 HD22 HG21 ' A' ' 95' ' ' VAL . 53.7 mt -86.29 -34.68 20.28 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 112.729 0.64 . . . . 1.2 112.729 -166.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.627 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 21.0 tt0 -49.84 -51.39 61.09 Favored Pre-proline 0 CA--C 1.539 0.545 0 O-C-N 123.198 0.311 . . . . 0.75 111.707 -174.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.589 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 24.6 Cg_exo -63.42 -43.3 18.32 Favored 'Trans proline' 0 C--N 1.359 1.1 0 C-N-CA 121.934 1.756 . . . . 0.56000000000000005 111.951 176.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 5.6 t-105 -59.45 -47.35 85.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.418 -0.81 . . . . 1.2 110.223 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.579 HG22 ' HA2' ' A' ' 147' ' ' GLY . 37.4 mt -48.39 -51.58 10.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.592 -0.731 . . . . 0.32000000000000001 111.095 174.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.627 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 70.1 mm-40 -57.15 -35.25 69.29 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.718 -0.673 . . . . 0.56999999999999995 111.303 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 9.5 mm-40 -64.8 -21.54 66.8 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.437 0.637 . . . . 0.78000000000000003 111.307 178.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.41 ' HB3' ' NE1' ' A' ' 97' ' ' TRP . 16.2 m-80 -110.65 9.21 22.91 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.256 -0.884 . . . . 0.93000000000000005 110.105 -174.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 116.43 -47.52 1.03 Allowed Glycine 0 N--CA 1.441 -1.029 0 CA-C-N 114.78 -1.1 . . . . 0.56000000000000005 112.704 174.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.579 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 132.01 -177.24 18.82 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.761 -0.733 . . . . 0.48999999999999999 111.961 -177.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.608 ' HB3' ' HB ' ' A' ' 46' ' ' VAL . 13.6 m-90 -71.01 -37.95 72.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.019 0.438 . . . . 3.5699999999999998 110.258 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.605 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 6.2 m-20 -64.07 -31.49 72.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.638 -0.71 . . . . 1.96 110.339 178.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.593 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 87.0 m -67.34 -40.04 85.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.068 -0.515 . . . . 0.67000000000000004 111.508 179.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.554 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 85.3 t80 -64.72 -31.06 72.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.797 0.808 . . . . 3.0 109.104 -178.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.605 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 87.4 t -59.67 -50.24 80.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 114.422 -1.263 . . . . 1.1499999999999999 110.35 172.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.79 -28.45 64.01 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.829 -1.078 . . . . 1.6699999999999999 111.518 176.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 150' ' ' THR . 10.2 mt -86.37 -56.13 3.58 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.458 -0.337 . . . . 1.3 111.26 -177.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -115.11 -44.25 3.03 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.871 -0.332 . . . . 4.2400000000000002 110.461 -178.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.5 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . 50.86 -160.17 1.61 Allowed Glycine 0 CA--C 1.509 -0.343 0 CA-C-O 121.813 0.674 . . . . 1.1000000000000001 114.597 178.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.821 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 23.9 t-20 -110.56 117.38 33.38 Favored 'General case' 0 N--CA 1.433 -1.289 0 CA-C-N 114.37 -0.915 . . . . 1.29 110.197 -177.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.73 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 19.0 m120 -93.46 -12.5 29.59 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.562 -0.29 . . . . 2.9900000000000002 110.668 -178.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -52.42 -53.92 38.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.862 -0.608 . . . . 2.52 110.529 176.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -86.0 -34.28 20.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.124 -0.489 . . . . 2.8700000000000001 111.025 178.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.73 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -56.08 -60.33 3.63 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.462 -0.335 . . . . 3.2000000000000002 111.827 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -69.42 -21.82 63.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.912 0.387 . . . . 3.7200000000000002 110.901 -177.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 15.9 t -74.43 -30.17 61.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.229 0.538 . . . . 4.1799999999999997 110.011 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -86.05 -17.36 35.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.496 0.665 . . . . 5.8200000000000003 109.88 178.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -67.1 -18.46 65.32 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.89 -1.05 . . . . 4.7699999999999996 111.313 -177.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -57.24 -44.73 93.22 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 121.109 -0.567 . . . . 5.0999999999999996 113.028 -176.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -69.52 -24.12 63.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.816 0.341 . . . . 5.7199999999999998 110.823 179.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.587 ' HA ' ' O ' ' A' ' 171' ' ' GLU . 40.2 mt-10 -75.5 -0.31 19.78 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.154 -0.475 . . . . 5.8799999999999999 111.193 -179.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.513 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 2.5 tmt_? -78.25 -33.56 49.61 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.278 -1.008 . . . . 7.3399999999999999 108.278 173.409 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -95.88 -37.89 10.51 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.506 -0.77 . . . . 6.9699999999999998 110.026 178.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . 0.587 ' O ' ' HA ' ' A' ' 168' ' ' GLU . 31.6 mt-10 -105.36 103.23 12.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.727 -0.67 . . . . 6.9699999999999998 110.054 177.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -81.37 125.79 30.82 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.448 -0.342 . . . . 9.3499999999999996 110.523 -176.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -55.59 119.72 6.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.783 -0.644 . . . . 11.4 110.4 178.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 33.3 p-80 -132.58 95.68 3.67 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.522 0.677 . . . . 11.52 110.909 -177.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -121.77 -29.0 4.41 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.37 -0.832 . . . . 14.48 109.169 174.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . 0.459 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 0.9 OUTLIER -154.54 145.02 22.18 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.336 -0.987 . . . . 15.369999999999999 108.336 177.481 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 33.7 m80 -64.89 -27.06 68.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.79 0.329 . . . . 16.02 110.555 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 176' ' ' HIS . 95.9 mt 74.61 -20.39 0.33 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.473 -0.785 . . . . 17.989999999999998 112.208 171.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . 0.428 ' C ' ' H ' ' A' ' 181' ' ' HIS . 33.4 tt0 65.68 -85.68 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 O-C-N 123.713 0.633 . . . . 19.190000000000001 110.602 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 24.7 t-80 70.95 -14.49 0.44 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.259 0.624 . . . . 22.260000000000002 111.941 173.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . 0.428 ' H ' ' C ' ' A' ' 179' ' ' GLU . 21.9 p-80 -152.91 156.29 38.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.392 -0.367 . . . . 22.510000000000002 110.022 179.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -65.03 150.44 48.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.167 -0.469 . . . . 24.890000000000001 111.536 -177.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 47.3 m-70 -87.5 157.9 19.07 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.854 -0.612 . . . . 25.579999999999998 109.598 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -71.6 -48.27 49.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.103 0.478 . . . . 27.370000000000001 110.137 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 66.2 m-70 . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.71 -0.662 . . . . 29.059999999999999 109.697 177.558 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.156 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . 0.544 ' O ' HG22 ' B' 1004 ' ' VAL . . . 115.68 159.76 12.19 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.903 -0.665 . . . . 2.9700000000000002 111.958 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . . . . . . . . . 13.4 m 56.93 -141.95 0.77 Allowed 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 122.432 0.293 . . . . 1.9399999999999999 110.69 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.854 ' HA ' ' HG ' ' B' 1008 ' ' LEU . 15.7 m 37.29 -88.95 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 124.821 1.249 . . . . 1.6299999999999999 113.953 173.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 0.828 ' H ' HG23 ' B' 1004 ' ' VAL . . . -35.38 -33.21 0.04 OUTLIER Glycine 0 C--N 1.349 1.258 0 CA-C-N 118.161 0.437 . . . . 1.2 114.026 168.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . 0.448 ' HA ' ' HD3' ' B' 1006 ' ' ARG . 26.2 mmt180 -102.63 -48.5 4.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.951 0.405 . . . . 2.8799999999999999 111.125 174.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . 0.474 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -63.23 -53.88 46.06 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.913 0.709 . . . . 1.3100000000000001 112.913 -169.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.883 HD12 HG13 ' A' ' 86' ' ' VAL . 3.1 mt -72.55 -40.41 66.72 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.335 -0.617 . . . . 1.3300000000000001 109.335 -171.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 1.114 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -47.73 -49.97 26.63 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 122.212 1.006 . . . . 0.88 109.92 169.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.866 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -69.14 -49.42 57.09 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 113.82 -1.537 . . . . 1.03 111.997 -175.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.693 ' CZ ' ' H8 ' ' B' 1100 ' ' 33B . 28.7 m-85 -68.4 -23.76 64.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.238 -0.437 . . . . 1.6699999999999999 111.161 -176.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -68.18 -23.81 74.72 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 116.062 -0.517 . . . . 0.78000000000000003 113.639 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.62 -2.87 12.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.274 0.472 . . . . 1.8999999999999999 112.274 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 32.8 m -109.59 7.71 24.68 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 111.901 0.334 . . . . 1.4399999999999999 111.901 -178.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.564 ' HB ' ' HA3' ' A' ' 98' ' ' GLY . 42.1 mt -94.36 78.4 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.984 0.421 . . . . 2.9100000000000001 111.097 -177.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -168.8 141.4 2.78 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.131 -0.692 . . . . 4.29 109.131 176.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 6.0 tpp180 -117.09 -78.17 0.58 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.822 0.344 . . . . 8.1699999999999999 110.457 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 116.721 -0.218 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.866 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 mmt . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 120.423 0.154 . . . . 6.21 110.852 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.0 m -80.56 151.41 29.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.865 0.364 . . . . 1.8700000000000001 111.151 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 -97.18 -6.27 35.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.579 0.704 . . . . 2.4199999999999999 109.707 178.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.434 ' HB3' ' OG ' ' A' ' 43' ' ' SER . 1.4 m -64.64 -26.47 68.4 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.071 -0.968 . . . . 1.25 112.208 -174.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.619 ' HB2' HD13 ' A' ' 134' ' ' LEU . 5.2 p30 -66.39 -28.56 68.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.674 0.274 . . . . 1.78 111.483 -179.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.588 ' O ' HG23 ' A' ' 10' ' ' VAL . 7.2 tpp180 -56.99 -46.14 82.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.021 -0.536 . . . . 1.3999999999999999 110.113 177.478 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.759 ' OE1' ' HA2' ' A' ' 40' ' ' GLY . 44.1 mt-10 -55.18 -49.71 71.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.123 -0.944 . . . . 0.68000000000000005 111.367 -178.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.519 HD21 ' CB ' ' A' ' 43' ' ' SER . 9.0 mt -58.7 -35.83 73.27 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.936 -1.029 . . . . 1.1599999999999999 110.271 -173.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.481 HG11 ' O ' ' A' ' 127' ' ' ALA . 75.8 t -70.97 -58.94 4.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.558 -0.747 . . . . 0.27000000000000002 109.985 174.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 6' ' ' ARG . 86.5 t -52.88 -55.62 11.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.864 -1.062 . . . . 0.33000000000000002 112.243 -174.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.42 -36.35 71.24 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.142 -0.481 . . . . 0.58999999999999997 110.385 -177.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.689 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 5.7 t80 -70.45 -49.38 49.24 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.847 -0.615 . . . . 1.6100000000000001 110.573 -178.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.993 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.0 mp -62.11 -38.64 89.66 Favored 'General case' 0 N--CA 1.462 0.161 0 C-N-CA 120.558 -0.457 . . . . 0.34000000000000002 110.489 178.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.433 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 28.6 t -55.65 -46.34 77.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.883 -0.599 . . . . 1.05 110.403 178.008 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.411 ' HD2' ' HZ1' ' A' ' 16' ' ' LYS . 38.6 t80 -69.04 -29.07 67.14 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.896 -0.593 . . . . 1.22 110.85 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.636 ' HG2' ' O ' ' A' ' 12' ' ' PHE . 10.0 mmpt? -71.71 -37.42 70.66 Favored 'General case' 0 CA--C 1.518 -0.255 0 C-N-CA 121.057 -0.257 . . . . 1.4099999999999999 110.709 -179.06 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.487 HD21 ' SG ' ' A' ' 111' ' ' CYS . 0.2 OUTLIER -66.64 -30.73 71.06 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.943 -0.391 . . . . 1.3500000000000001 109.943 174.761 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.0 t -64.05 -25.55 68.16 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.978 -0.556 . . . . 0.93999999999999995 111.451 -179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -72.68 -18.53 61.54 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.863 0.84 . . . . 1.3700000000000001 110.095 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.54 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 19.0 mmmt -104.83 -26.36 12.26 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.249 -1.341 . . . . 2.2000000000000002 109.281 -175.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.35 26.53 7.7 Favored Glycine 0 N--CA 1.438 -1.193 0 CA-C-N 113.815 -1.539 . . . . 0.53000000000000003 111.433 178.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.666 ' HB3' ' HE2' ' A' ' 27' ' ' PHE . 96.0 m-85 -115.46 166.82 11.46 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.335 -0.432 . . . . 0.76000000000000001 110.298 177.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.9 t -110.8 145.76 37.59 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.274 -0.421 . . . . 0.52000000000000002 110.632 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.433 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 1.7 t90 -68.88 -49.99 53.52 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.248 -0.433 . . . . 3.3599999999999999 109.897 174.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.8 p -61.77 -37.46 84.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.642 -0.708 . . . . 1.3700000000000001 111.45 -173.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -58.88 -28.75 66.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.209 -0.451 . . . . 1.1100000000000001 111.477 178.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.666 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 17.4 m-85 -117.04 16.31 15.04 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.035 0.445 . . . . 1.28 110.726 -175.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.61 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 78.9 p -100.46 179.52 4.42 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 121.4 0.619 . . . . 1.8100000000000001 111.814 -174.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.611 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 14.3 t70 -167.05 -13.17 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.399 -1.273 . . . . 2.3100000000000001 108.515 -178.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.931 HG23 ' H ' ' A' ' 31' ' ' GLU . 9.0 m -67.48 -72.0 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.232 -1.349 . . . . 0.92000000000000004 111.707 179.085 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.931 ' H ' HG23 ' A' ' 30' ' ' VAL . 28.4 mm-40 -94.48 2.54 55.72 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.846 -0.798 . . . . 2.7400000000000002 108.846 177.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.611 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 6.2 tt0 -61.17 -68.48 0.31 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.8 -1.091 . . . . 1.45 111.084 -177.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.418 ' ND2' ' H ' ' A' ' 33' ' ' ASN . 2.4 p30 -87.16 -35.11 18.79 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.732 -0.667 . . . . 1.8700000000000001 111.268 -175.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.449 ' O ' ' HA ' ' A' ' 31' ' ' GLU . 10.0 ptt180 -112.78 139.93 47.99 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.893 -0.594 . . . . 3.3900000000000001 110.409 178.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 19.8 p -107.72 114.3 28.17 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.186 0.517 . . . . 2.25 110.481 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -117.32 -60.71 1.8 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.721 -0.672 . . . . 3.3399999999999999 111.098 -175.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.461 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . . . -71.36 139.91 84.63 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.596 -0.729 . . . . 1.9199999999999999 110.967 177.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.555 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 13.1 Cg_exo -70.16 178.0 5.27 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 123.145 2.564 . . . . 1.8700000000000001 111.4 174.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -74.39 -9.78 58.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.652 0.739 . . . . 4.6399999999999997 110.216 178.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.759 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 151.5 66.76 0.01 OUTLIER Glycine 0 N--CA 1.439 -1.163 0 CA-C-N 115.215 -0.902 . . . . 2.1499999999999999 111.124 -178.005 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.884 HG23 ' H ' ' A' ' 42' ' ' GLU . 2.6 t -63.55 -73.64 0.11 Allowed 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 120.345 -0.542 . . . . 1.1200000000000001 109.931 -174.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.884 ' H ' HG23 ' A' ' 41' ' ' THR . 14.5 pt-20 -93.32 -31.66 14.59 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 122.618 1.199 . . . . 2.02 108.631 166.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 1.002 ' HA ' HG13 ' A' ' 46' ' ' VAL . 39.4 m -68.94 -17.21 63.92 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 113.071 -1.877 . . . . 1.25 114.68 -167.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.43 ' HB2' ' HA3' ' A' ' 40' ' ' GLY . 45.1 tt0 -52.82 -39.82 62.76 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 118.439 0.563 . . . . 1.9099999999999999 111.001 -178.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -82.08 -40.38 22.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.592 -0.276 . . . . 0.52000000000000002 111.205 176.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 1.002 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.8 m -69.43 -36.95 74.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 C-N-CA 120.896 -0.321 . . . . 1.4099999999999999 111.313 -175.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.1 ptpt -71.27 -34.94 71.15 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 108.776 -0.824 . . . . 0.67000000000000004 108.776 178.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.596 HE22 ' HD3' ' A' ' 51' ' ' ARG . 4.3 mm100 -64.21 -32.88 74.63 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.161 -0.927 . . . . 0.98999999999999999 110.42 177.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.682 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -77.42 -42.44 36.13 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.886 -0.597 . . . . 0.41999999999999998 110.779 175.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.498 HD12 ' CE2' ' A' ' 151' ' ' PHE . 0.7 OUTLIER -66.51 -23.13 66.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.001 -0.545 . . . . 1.3300000000000001 112.242 -176.387 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.596 ' HD3' HE22 ' A' ' 48' ' ' GLN . 16.2 ptm180 -78.12 -29.13 48.72 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 107.863 -1.162 . . . . 2.1699999999999999 107.863 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.946 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 6.6 mm-40 -74.42 -52.13 12.93 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 113.565 -1.652 . . . . 1.1000000000000001 109.835 177.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.07 -44.39 92.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.823 -0.626 . . . . 0.53000000000000003 111.025 178.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.58 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.86 -36.04 92.84 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 121.045 -0.598 . . . . 0.69999999999999996 111.984 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -64.33 -37.11 86.34 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 110.34 -0.245 . . . . 1.04 110.34 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.534 ' HA ' HD11 ' A' ' 59' ' ' LEU . 24.3 mm-40 -60.5 -27.06 67.3 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.544 0.528 . . . . 2.29 111.292 177.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.579 ' HD2' ' HB3' ' A' ' 105' ' ' SER . 36.8 t80 -80.33 -26.4 38.77 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.986 0.422 . . . . 2.29 110.271 175.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.58 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 46.4 mt-10 -67.94 -60.78 2.24 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.933 -0.576 . . . . 1.3 111.951 -174.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.612 HD22 ' N ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -55.71 -33.76 64.49 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 118.18 0.445 . . . . 1.54 110.995 -178.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.612 ' N ' HD22 ' A' ' 59' ' ' LEU . 59.7 mtt180 -60.22 -62.65 1.71 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.759 -0.655 . . . . 2.5800000000000001 112.049 172.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -92.71 -2.98 55.58 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 113.339 0.866 . . . . 5.3200000000000003 113.339 -168.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.868 ' HA ' ' CE2' ' A' ' 65' ' ' PHE . 32.6 ttt180 -52.81 -45.61 67.31 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.895 0.702 . . . . 4.4800000000000004 112.895 -171.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -69.56 -14.04 62.64 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.964 -0.294 . . . . 4.7199999999999998 111.212 -178.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.664 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.35 -60.77 1.84 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.012 0.375 . . . . 1.1699999999999999 112.012 -178.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.89 ' HA ' HD11 ' A' ' 68' ' ' LEU . 4.9 p90 -57.88 -29.45 65.04 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 113.751 1.019 . . . . 2.8100000000000001 113.751 -167.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 8.3 t -90.74 -11.33 39.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.312 0.577 . . . . 2.1899999999999999 110.43 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -90.8 -50.97 5.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.779 0.8 . . . . 2.7200000000000002 110.413 -177.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.984 HD13 HD11 ' A' ' 72' ' ' LEU . 0.4 OUTLIER -67.44 -4.29 10.85 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.357 -1.292 . . . . 1.5600000000000001 114.4 -174.372 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.803 ' HA ' HD13 ' A' ' 72' ' ' LEU . 3.2 p -45.78 -23.75 0.3 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 118.779 0.718 . . . . 0.69999999999999996 112.86 -171.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 73.7 m -46.48 -60.15 2.53 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.1 0.56 . . . . 1.3400000000000001 111.508 166.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.686 HE21 ' CB ' ' A' ' 68' ' ' LEU . 2.0 mp0 -47.79 -51.5 22.27 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 124.441 1.097 . . . . 1.4199999999999999 111.39 176.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.984 HD11 HD13 ' A' ' 68' ' ' LEU . 2.9 mp -77.59 -19.82 54.97 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.236 -1.347 . . . . 1.3700000000000001 111.339 -166.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.9 t-80 54.54 50.0 17.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.817 0.818 . . . . 2.7200000000000002 109.103 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.731 HG13 HG22 ' A' ' 69' ' ' THR . 30.9 mm -57.44 105.67 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 114.113 -1.403 . . . . 0.91000000000000003 111.33 -177.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.757 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.91 -169.55 0.22 Allowed Pre-proline 0 C--N 1.315 -0.913 0 N-CA-C 107.022 -1.473 . . . . 0.51000000000000001 107.022 -169.146 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.757 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 65.9 Cg_exo -28.92 165.38 0.0 OUTLIER 'Trans proline' 0 C--N 1.357 1.003 0 C-N-CA 124.674 3.583 . . . . 0.46999999999999997 115.236 164.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.647 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -28.72 -32.67 0.01 OUTLIER Glycine 0 N--CA 1.469 0.834 0 N-CA-C 117.523 1.769 . . . . 0.40000000000000002 117.523 -171.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.443 ' N ' ' O ' ' A' ' 76' ' ' PRO . 37.3 p -64.43 3.67 0.45 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 118.125 0.962 . . . . 0.56000000000000005 112.618 -176.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.1 -14.36 62.96 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.235 0.54 . . . . 0.34000000000000002 109.608 171.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.647 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 13.3 p90 -72.66 -20.81 61.18 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.791 -0.64 . . . . 4.1299999999999999 109.44 175.115 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.479 ' O ' ' HG3' ' A' ' 85' ' ' GLN . 57.0 mt-30 -79.08 -30.05 43.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.442 0.639 . . . . 1.03 109.854 177.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.5 m -70.55 -49.17 50.82 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.9 -1.045 . . . . 0.47999999999999998 109.263 173.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.491 ' O ' HG13 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -68.72 -16.69 63.89 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.053 -1.431 . . . . 1.1799999999999999 110.773 176.264 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.578 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.5 tt0 -70.71 -52.43 21.0 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 116.086 -0.507 . . . . 0.80000000000000004 110.809 178.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' A' ' 81' ' ' GLN . 58.4 mt-30 -45.64 -40.53 9.16 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 114.802 -1.09 . . . . 1.6200000000000001 111.207 -179.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.918 ' HA ' ' HA2' ' B' 1005 ' ' GLY . 1.2 p -86.47 -47.71 16.12 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-N 113.55 -1.659 . . . . 1.3 111.697 -173.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.578 HG12 ' HA ' ' A' ' 84' ' ' GLU . 8.1 p -61.95 -24.95 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.882 0.849 . . . . 0.84999999999999998 109.835 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.451 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 0.6 OUTLIER -62.11 -44.83 95.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.266 -1.334 . . . . 0.91000000000000003 110.629 178.518 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.844 ' HB3' ' HB2' ' B' 1009 ' ' ALA . 7.9 mm-40 -71.66 -37.92 70.73 Favored 'General case' 0 CA--C 1.495 -1.164 0 CA-C-O 121.719 0.771 . . . . 2.8700000000000001 109.758 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.514 HD23 ' HD2' ' A' ' 99' ' ' ARG . 16.3 mt -59.78 -19.03 47.95 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 113.781 -1.554 . . . . 1.28 111.884 -172.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.654 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 84.9 t80 -105.04 -35.58 7.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.51 0.672 . . . . 2.2999999999999998 111.489 -177.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.451 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 8.4 ptm180 -84.0 -36.41 23.18 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.863 -0.608 . . . . 5.0599999999999996 111.471 -172.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -95.85 21.21 8.83 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.901 -0.59 . . . . 3.1200000000000001 112.58 -170.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.19 68.41 0.11 Allowed Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 117.665 -2.207 . . . . 2.3100000000000001 115.814 176.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.654 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 60.8 t -74.98 102.1 2.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 118.599 1.2 . . . . 1.0600000000000001 111.243 174.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.506 HD22 ' HB2' ' A' ' 99' ' ' ARG . 0.3 OUTLIER -111.54 -173.18 2.19 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.547 -1.206 . . . . 2.1200000000000001 108.402 173.072 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.573 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 7.5 m95 -61.98 -55.31 30.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.707 0.289 . . . . 3.3399999999999999 111.245 177.092 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -69.68 -15.46 71.09 Favored Glycine 0 CA--C 1.519 0.314 0 C-N-CA 120.943 -0.646 . . . . 0.68999999999999995 113.097 -178.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.592 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 20.3 tpp180 -69.82 -43.49 71.91 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.218 0.532 . . . . 4.2400000000000002 110.622 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.481 ' O ' ' HD1' ' A' ' 104' ' ' PHE . 61.2 mt -68.09 -34.98 69.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.447 -0.797 . . . . 0.44 111.38 -175.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -60.74 -29.19 44.59 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-O 120.841 0.353 . . . . 1.3500000000000001 110.774 179.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.436 ' O ' ' HD1' ' A' ' 106' ' ' PHE . . . -62.55 -46.93 86.1 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.447 0.641 . . . . 0.44 110.268 177.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.619 ' HA ' ' CE1' ' A' ' 106' ' ' PHE . 30.8 t80 -53.43 -37.71 62.82 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.356 -1.293 . . . . 1.49 111.211 177.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.671 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 47.7 m-85 -76.53 -39.47 52.84 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.298 -0.41 . . . . 3.29 111.116 178.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.689 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 22.6 t -63.04 -54.86 31.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.013 -0.54 . . . . 1.1899999999999999 111.317 -176.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.619 ' CE1' ' HA ' ' A' ' 103' ' ' PHE . 3.9 p90 -76.81 -23.51 52.82 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.436 -0.506 . . . . 2.8900000000000001 110.41 -177.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -68.38 -44.64 73.12 Favored Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 110.8 -0.92 . . . . 0.29999999999999999 110.8 174.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.993 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.32 -31.18 79.64 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.874 -0.679 . . . . 0.23000000000000001 111.53 175.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -76.0 -28.87 57.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.787 0.327 . . . . 0.31 110.745 176.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.46 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.66 -41.78 98.17 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.083 -1.08 . . . . 1.1200000000000001 108.083 178.366 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.699 ' SG ' HG22 ' A' ' 123' ' ' VAL . 16.9 t -49.63 -51.66 36.14 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 113.449 -1.705 . . . . 0.26000000000000001 110.964 172.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.538 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 69.1 t -65.66 -40.94 89.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.346 -0.388 . . . . 0.34999999999999998 111.924 -177.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.714 ' HB3' HG21 ' A' ' 74' ' ' ILE . 18.3 mm-40 -63.03 -22.85 67.14 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.238 0.542 . . . . 2.5099999999999998 110.499 178.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.488 ' HB3' ' HB2' ' A' ' 122' ' ' LEU . 26.4 m -76.99 -37.76 54.5 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.977 -0.749 . . . . 0.28000000000000003 108.977 174.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' ' 111' ' ' CYS . 98.1 t -66.17 -35.11 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.147 -0.933 . . . . 1.23 109.332 179.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.512 ' OD2' ' HD3' ' A' ' 117' ' ' LYS . 25.9 t70 -52.0 -51.22 58.76 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 113.48 -1.691 . . . . 0.59999999999999998 111.597 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.512 ' HD3' ' OD2' ' A' ' 116' ' ' ASP . 12.7 mmtp -85.38 13.78 6.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.017 -0.538 . . . . 1.6200000000000001 110.282 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.464 ' HA ' HE21 ' A' ' 120' ' ' GLN . 46.1 mt-10 61.79 44.38 8.68 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.715 0.769 . . . . 1.8799999999999999 110.53 -178.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.494 ' HB3' HD23 ' A' ' 122' ' ' LEU . 25.8 mtm -119.74 44.8 2.3 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 107.871 -1.159 . . . . 0.31 107.871 -179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.464 HE21 ' HA ' ' A' ' 118' ' ' GLU . 3.1 mt-30 -60.4 -7.2 1.9 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.52 -1.218 . . . . 1.1499999999999999 112.845 -175.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.508 HG23 HD22 ' A' ' 122' ' ' LEU . 27.4 m -67.29 -25.14 32.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.628 0.251 . . . . 0.46000000000000002 111.205 172.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.523 HD13 ' HD3' ' A' ' 125' ' ' ARG . 3.5 mm? -70.93 -29.33 65.34 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 110.161 -0.311 . . . . 0.26000000000000001 110.161 177.449 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.699 HG22 ' SG ' ' A' ' 111' ' ' CYS . 72.2 t -44.79 -53.57 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 123.841 0.713 . . . . 0.25 111.78 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.61 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 0.0 OUTLIER -70.68 -37.15 73.6 Favored 'General case' 0 N--CA 1.437 -1.086 0 CA-C-N 116.057 -0.52 . . . . 1.3500000000000001 111.244 -179.565 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.523 ' HD3' HD13 ' A' ' 122' ' ' LEU . 60.8 mtp180 -62.36 -57.05 12.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 116.142 -0.481 . . . . 2.6699999999999999 110.502 -179.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.581 HG22 ' SD ' ' A' ' 130' ' ' MET . 76.7 mt -52.53 -49.82 42.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.677 -0.692 . . . . 0.23000000000000001 110.613 -178.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.593 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.96 -36.84 70.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.942 0.401 . . . . 0.28999999999999998 111.193 179.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.75 -60.86 2.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.336 0.589 . . . . 0.28000000000000003 110.397 176.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -60.17 -32.61 71.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.638 -1.165 . . . . 3.9100000000000001 111.227 -176.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.584 ' SD ' HD11 ' A' ' 13' ' ' LEU . 89.2 mtp -63.51 -56.43 16.11 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.954 0.407 . . . . 1.0800000000000001 110.765 177.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.441 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -61.17 -37.03 81.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.27 -0.423 . . . . 0.25 110.545 179.394 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.425 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 98.0 m -63.22 -45.12 93.11 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.454 -0.339 . . . . 0.40000000000000002 111.232 177.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -56.45 -40.34 74.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.176 0.512 . . . . 3.1299999999999999 109.877 177.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 1.001 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.2 tt -65.06 -49.67 69.17 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.313 -0.625 . . . . 0.94999999999999996 109.313 175.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . 0.425 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 4.7 m-80 -49.91 -49.12 50.87 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.792 -0.64 . . . . 0.46000000000000002 111.905 179.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -81.97 -54.54 5.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.15 -0.477 . . . . 0.58999999999999997 111.86 -176.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.76 -51.03 5.43 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.283 0.846 . . . . 1.45 113.283 -169.012 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 1.001 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -79.88 -44.18 20.91 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 114.054 1.131 . . . . 1.2 114.054 -165.006 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.622 ' HA ' HD12 ' A' ' 142' ' ' ILE . 37.0 tt0 -47.18 -51.73 39.65 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 112.69 0.626 . . . . 0.75 112.69 -174.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.579 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 51.1 Cg_exo -52.75 -50.66 13.29 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 121.962 1.774 . . . . 0.56000000000000005 111.784 177.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 4.2 t-105 -58.44 -50.75 72.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.51 -0.768 . . . . 1.2 110.441 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.622 HD12 ' HA ' ' A' ' 139' ' ' GLU . 54.7 mt -46.43 -53.87 2.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.117 -0.492 . . . . 0.32000000000000001 111.613 175.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.603 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 78.3 mm-40 -59.16 -34.15 71.76 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.689 -0.687 . . . . 0.56999999999999995 111.723 -178.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.532 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 67.8 mm-40 -63.3 -25.76 68.46 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.573 0.701 . . . . 0.78000000000000003 111.029 177.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.623 HD22 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -96.06 -16.67 21.46 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.182 -0.917 . . . . 0.93000000000000005 109.625 -171.855 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 142.62 -40.05 1.3 Allowed Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.478 -0.783 . . . . 0.56000000000000005 112.665 175.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.542 ' H ' ' HH2' ' A' ' 97' ' ' TRP . . . 120.36 170.62 14.3 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.958 -0.639 . . . . 0.48999999999999999 111.675 -178.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.696 ' HZ2' HD21 ' A' ' 134' ' ' LEU . 6.8 m0 -65.92 -35.09 79.65 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.923 0.342 . . . . 3.5699999999999998 111.923 -175.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.542 ' O ' ' HB ' ' A' ' 152' ' ' VAL . 8.8 m-20 -63.23 -31.08 72.14 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 120.697 0.284 . . . . 1.96 110.247 177.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.531 ' O ' HD13 ' A' ' 154' ' ' LEU . 72.3 m -70.11 -36.06 74.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.416 -0.356 . . . . 0.67000000000000004 110.867 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.573 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 91.1 t80 -62.27 -33.45 74.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.787 -0.82 . . . . 3.0 108.787 178.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.542 ' HB ' ' O ' ' A' ' 149' ' ' ASP . 90.8 t -63.88 -52.83 51.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 114.438 -1.255 . . . . 1.1499999999999999 111.131 174.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.517 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 24.0 mm-40 -48.75 -46.99 41.97 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.125 -0.943 . . . . 1.6699999999999999 111.643 176.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.531 HD13 ' O ' ' A' ' 150' ' ' THR . 8.2 mp -78.17 -60.81 2.22 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.998 0.74 . . . . 1.3 112.998 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -119.85 27.48 8.67 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.187 -0.46 . . . . 4.2400000000000002 110.632 -167.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.682 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -57.62 165.44 6.44 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 115.619 -0.719 . . . . 1.1000000000000001 114.336 -179.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.946 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 29.4 t-20 -44.77 111.29 0.3 Allowed 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 113.308 -1.446 . . . . 1.29 112.107 -177.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 1.093 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 0.8 OUTLIER -76.45 -16.95 59.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.043 -0.526 . . . . 2.9900000000000002 111.481 -174.059 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.422 ' HB3' ' OD1' ' A' ' 157' ' ' ASN . . . -57.42 -34.02 68.5 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.284 0.564 . . . . 2.52 109.607 171.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' A' ' 163' ' ' SER . . . -99.3 -34.98 10.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.662 -0.699 . . . . 2.8700000000000001 110.698 174.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 1.093 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -59.37 -48.49 81.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.105 -0.498 . . . . 3.2000000000000002 111.689 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.431 ' HA ' ' CB ' ' A' ' 165' ' ' LYS . 38.9 mt-10 -70.2 -15.09 62.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.632 0.253 . . . . 3.7200000000000002 111.064 -178.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.455 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 32.8 t -68.68 -40.01 80.31 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.937 -0.764 . . . . 4.1799999999999997 108.937 173.46 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . 0.614 ' HA ' ' HG2' ' A' ' 167' ' ' GLN . 1.8 mpp_? -78.51 -26.53 45.91 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.96 -0.564 . . . . 5.8200000000000003 110.653 175.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.431 ' CB ' ' HA ' ' A' ' 162' ' ' GLU . 40.3 ttmt -56.99 -39.15 74.12 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.829 -0.623 . . . . 4.7699999999999996 110.644 177.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -84.93 -39.98 8.34 Favored Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.89 -0.671 . . . . 5.0999999999999996 113.261 -177.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.614 ' HG2' ' HA ' ' A' ' 164' ' ' ARG . 14.7 pt20 -77.22 -41.55 40.88 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 117.099 0.449 . . . . 5.7199999999999998 111.591 -176.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.404 ' N ' ' HG3' ' A' ' 167' ' ' GLN . 24.6 mm-40 -81.07 13.29 2.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.91 0.386 . . . . 5.8799999999999999 110.245 -178.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.455 ' O ' ' HD3' ' A' ' 169' ' ' ARG . 4.3 tmt_? -58.02 -32.59 68.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.808 -0.633 . . . . 7.3399999999999999 109.853 178.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.427 ' N ' HD22 ' A' ' 170' ' ' LEU . 3.2 mm? -72.83 -25.22 61.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.466 -0.788 . . . . 6.9699999999999998 111.171 -178.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -100.92 -30.47 11.64 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.123 -0.49 . . . . 6.9699999999999998 111.26 -176.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 57.6 m80 64.38 -169.35 0.2 Allowed 'General case' 0 C--O 1.232 0.164 0 CA-C-N 115.809 -0.632 . . . . 9.3499999999999996 109.781 -173.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 38.5 m80 61.29 32.9 19.22 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.723 0.297 . . . . 11.4 110.661 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 24.9 p80 -78.47 14.48 1.24 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.79 0.328 . . . . 11.52 111.709 -173.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -77.25 -11.49 59.83 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.914 -0.773 . . . . 14.48 108.914 166.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -121.27 163.13 19.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.859 -1.064 . . . . 15.369999999999999 108.343 173.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -118.27 135.01 54.54 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.125 0.488 . . . . 16.02 110.983 -178.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.666 HD23 ' H ' ' A' ' 178' ' ' LEU . 1.7 pt? -52.31 143.03 15.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.863 -1.062 . . . . 17.989999999999998 112.687 -176.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -99.97 -55.02 2.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.429 -0.805 . . . . 19.190000000000001 110.317 176.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 41.0 m170 62.49 96.62 0.04 OUTLIER 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.304 -0.862 . . . . 22.260000000000002 109.856 -170.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -79.61 66.26 5.02 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.747 -0.66 . . . . 22.510000000000002 110.641 -174.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 18.0 t60 -107.22 -37.07 6.37 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.238 -1.023 . . . . 24.890000000000001 108.238 173.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -77.34 102.61 6.85 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.143 -0.935 . . . . 25.579999999999998 109.178 171.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 21.5 p-80 -109.85 148.86 30.75 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.804 -0.635 . . . . 27.370000000000001 110.15 -176.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 . . . . . 0 C--O 1.246 0.907 0 CA-C-O 118.398 -0.81 . . . . 29.059999999999999 109.828 -179.885 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.141 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -178.63 105.32 0.2 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.729 -0.748 . . . . 2.9700000000000002 112.345 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.771 ' HB3' ' O62' ' B' 1100 ' ' 33B . 6.8 m -123.91 -146.13 0.35 Allowed 'General case' 0 C--N 1.322 -0.62 0 O-C-N 122.683 -0.304 . . . . 1.9399999999999999 110.316 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.804 HG23 ' H ' ' B' 1005 ' ' GLY . 9.4 m 50.47 -79.2 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.348 0 C-N-CA 125.085 1.354 . . . . 1.6299999999999999 113.224 178.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 0.918 ' HA2' ' HA ' ' A' ' 86' ' ' VAL . . . -47.1 -60.84 4.81 Favored Glycine 0 N--CA 1.43 -1.702 0 C-N-CA 119.911 -1.138 . . . . 1.2 110.594 171.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' B' 1006 ' ' ARG . 29.4 mmt180 -56.63 -40.31 75.18 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 111.989 0.366 . . . . 2.8799999999999999 111.989 176.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -66.98 -52.39 43.35 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-O 120.692 0.282 . . . . 1.3100000000000001 111.456 -175.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.819 ' HB2' HG23 ' A' ' 86' ' ' VAL . 3.8 mm? -75.14 -37.41 61.39 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.842 0.353 . . . . 1.3300000000000001 110.872 -174.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 0.844 ' HB2' ' HB3' ' A' ' 89' ' ' GLU . . . -45.72 -47.54 15.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.743 0.782 . . . . 0.88 110.057 165.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.891 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -75.56 -60.4 2.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.726 -1.124 . . . . 1.03 112.121 -177.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.631 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 50.2 m-85 -59.0 -33.25 70.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.945 -0.571 . . . . 1.6699999999999999 111.829 -176.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -67.2 -20.79 71.5 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.886 -0.673 . . . . 0.78000000000000003 113.417 -175.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 28.3 t70 -67.56 -20.16 65.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.868 0.334 . . . . 1.8999999999999999 111.213 178.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 10.6 m -81.04 0.02 37.71 Favored 'General case' 0 C--O 1.227 -0.106 0 CA-C-O 120.901 0.381 . . . . 1.4399999999999999 110.952 -175.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.483 HD11 ' CD1' ' A' ' 57' ' ' PHE . 2.9 mt -99.45 11.07 6.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.698 0.761 . . . . 2.9100000000000001 109.811 177.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . 0.414 HD22 ' HG3' ' B' 1017 ' ' ARG . 6.9 t30 -146.42 -48.15 0.2 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.668 -0.696 . . . . 4.29 110.187 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . 0.414 ' HG3' HD22 ' B' 1016 ' ' ASN . 86.7 mtm180 -116.24 -82.45 0.62 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.078 -0.51 . . . . 8.1699999999999999 109.955 177.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.532 -0.304 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.891 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.2 tpp . . . . . 0 N--CA 1.477 0.88 0 CA-C-O 120.535 0.207 . . . . 6.21 111.103 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.6 p -132.49 -32.3 1.33 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.778 0.288 . . . . 1.8700000000000001 111.778 -177.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 31.1 tp60 -86.38 1.84 49.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.643 0.735 . . . . 2.4199999999999999 110.008 -178.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.685 ' HA ' ' HB2' ' A' ' 37' ' ' ALA . 20.0 m -69.77 -15.42 63.13 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.02 -0.991 . . . . 1.25 112.351 -176.381 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.592 ' HB3' HD22 ' A' ' 134' ' ' LEU . 1.1 p30 -61.19 -18.7 59.57 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.092 -0.504 . . . . 1.78 110.848 175.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.558 ' O ' HG23 ' A' ' 10' ' ' VAL . 20.0 tpp85 -60.25 -45.5 93.04 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.861 -0.609 . . . . 1.3999999999999999 109.844 175.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.488 ' HG3' ' HB3' ' A' ' 37' ' ' ALA . 42.6 mt-10 -59.56 -52.86 63.72 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.827 -0.624 . . . . 0.68000000000000005 111.274 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.57 HD22 ' HA ' ' A' ' 5' ' ' ASN . 2.7 mp -45.66 -37.46 5.76 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.223 -0.899 . . . . 1.1599999999999999 111.47 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 70.0 t -76.81 -62.52 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.055 -0.521 . . . . 0.27000000000000002 110.659 175.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 6' ' ' ARG . 86.5 t -52.14 -49.96 37.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.373 -0.831 . . . . 0.33000000000000002 112.841 -174.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -54.07 -32.64 55.28 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 123.508 0.505 . . . . 0.58999999999999997 110.653 -175.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.558 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 55.7 t80 -84.12 -44.64 13.82 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.285 -0.416 . . . . 1.6100000000000001 111.548 -179.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.889 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.7 mp -58.13 -40.5 81.42 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 120.024 -0.67 . . . . 0.34000000000000002 109.98 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.413 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 23.1 t -60.73 -40.89 94.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.99 -0.55 . . . . 1.05 110.312 176.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -73.51 -25.39 60.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.814 -0.63 . . . . 1.22 111.309 -178.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.716 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.6 OUTLIER -78.52 -50.24 11.95 Favored 'General case' 0 N--CA 1.432 -1.37 0 CA-C-O 121.226 0.536 . . . . 1.4099999999999999 110.094 -174.637 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.701 HD21 ' SG ' ' A' ' 111' ' ' CYS . 13.2 mt -55.18 -29.78 58.56 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.511 -0.768 . . . . 1.3500000000000001 111.277 173.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.7 t -60.81 -29.02 69.21 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.47 -0.787 . . . . 0.93999999999999995 111.908 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.716 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 20.8 pt20 -75.29 -16.72 60.41 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.201 0.524 . . . . 1.3700000000000001 110.932 -176.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.798 ' HD2' HG22 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -100.66 -23.69 14.59 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 122.197 0.999 . . . . 2.2000000000000002 108.58 179.265 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.01 26.28 7.55 Favored Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 113.651 -1.613 . . . . 0.53000000000000003 112.468 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.489 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 86.8 m-85 -112.61 166.61 11.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.542 0.21 . . . . 0.76000000000000001 110.801 176.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.1 t -109.31 151.29 26.79 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.263 -0.426 . . . . 0.52000000000000002 110.632 -178.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.671 ' CH2' ' HB2' ' A' ' 31' ' ' GLU . 3.0 t90 -75.06 -52.9 9.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.073 -0.512 . . . . 3.3599999999999999 110.356 175.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.433 ' HB2' ' CE3' ' A' ' 24' ' ' TRP . 22.6 t -72.45 -18.55 61.68 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.227 -0.442 . . . . 1.3700000000000001 111.495 -172.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -65.53 -22.48 66.72 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.191 -0.604 . . . . 1.1100000000000001 110.785 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -108.96 -33.75 6.83 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.826 -0.625 . . . . 1.28 110.863 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.701 ' HB3' HG22 ' A' ' 30' ' ' VAL . 10.6 m -101.54 143.84 31.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.71 0.767 . . . . 1.8100000000000001 112.112 -177.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.502 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 15.4 t70 -108.15 -7.4 16.05 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 114.162 -1.381 . . . . 2.3100000000000001 109.383 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.843 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.0 m -53.61 -72.97 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 114.067 -1.424 . . . . 0.92000000000000004 112.915 -170.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.843 ' H ' HG23 ' A' ' 30' ' ' VAL . 20.5 mm-40 -91.57 1.5 57.1 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.965 -0.754 . . . . 2.7400000000000002 108.965 178.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.502 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.1 tt0 -64.74 -44.11 91.17 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 114.834 -1.075 . . . . 1.45 110.205 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -108.07 -66.1 1.07 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.608 -0.724 . . . . 1.8700000000000001 110.728 -179.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.462 ' HG2' ' O ' ' A' ' 30' ' ' VAL . 11.3 ptp180 -79.53 167.56 20.59 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.342 -0.614 . . . . 3.3900000000000001 109.342 176.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 21.6 p -135.05 113.98 11.99 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.036 0.446 . . . . 2.25 110.361 176.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -71.81 -62.41 1.43 Allowed 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.668 -0.697 . . . . 3.3399999999999999 110.22 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.685 ' HB2' ' HA ' ' A' ' 4' ' ' SER . . . -99.5 163.87 17.72 Favored Pre-proline 0 C--N 1.314 -0.939 0 CA-C-N 115.294 -0.866 . . . . 1.9199999999999999 110.514 176.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.479 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 50.1 Cg_exo -58.64 -170.69 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.211 2.607 . . . . 1.8700000000000001 112.63 171.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -79.67 10.49 3.95 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.222 0.534 . . . . 4.6399999999999997 110.4 176.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.716 ' HA2' ' OG ' ' A' ' 43' ' ' SER . . . 128.94 71.15 0.14 Allowed Glycine 0 N--CA 1.438 -1.202 0 CA-C-N 115.652 -0.703 . . . . 2.1499999999999999 111.403 -176.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.698 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.3 t -74.11 -71.94 0.3 Allowed 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 120.387 -0.525 . . . . 1.1200000000000001 110.145 -177.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.698 ' H ' HG23 ' A' ' 41' ' ' THR . 0.0 OUTLIER -92.18 -34.98 14.09 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.551 0.691 . . . . 2.02 109.393 169.095 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.772 ' HA ' HG13 ' A' ' 46' ' ' VAL . 7.3 p -47.95 -39.29 18.89 Favored 'General case' 0 C--O 1.214 -0.794 0 CA-C-N 113.943 -1.481 . . . . 1.25 112.846 -171.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -39.4 -51.17 2.11 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 123.946 0.779 . . . . 1.9099999999999999 111.989 -175.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.418 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -75.72 -42.61 50.29 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 121.186 -0.206 . . . . 0.52000000000000002 111.414 179.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.772 HG13 ' HA ' ' A' ' 43' ' ' SER . 0.5 OUTLIER -68.0 -44.87 84.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 N-CA-C 111.652 0.241 . . . . 1.4099999999999999 111.652 -175.902 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.769 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.0 ptpt -67.35 -39.3 85.73 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.293 -0.632 . . . . 0.67000000000000004 109.293 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.491 ' HB3' ' HB2' ' A' ' 157' ' ' ASN . 5.6 mm100 -57.83 -43.83 86.07 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 115.631 -0.713 . . . . 0.98999999999999999 111.635 174.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.588 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -70.46 -34.95 73.0 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.243 0.544 . . . . 0.41999999999999998 110.42 178.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.451 ' HG ' ' CE1' ' A' ' 104' ' ' PHE . 4.0 tp -64.84 -28.48 69.58 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.322 -0.854 . . . . 1.3300000000000001 111.695 -175.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.427 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 3.8 ptp85 -86.88 -23.04 25.37 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.271 0.558 . . . . 2.1699999999999999 110.108 -177.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.569 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.3 mm-40 -70.63 -47.42 60.14 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.091 -0.959 . . . . 1.1000000000000001 109.826 175.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.03 -36.47 75.09 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.736 -0.665 . . . . 0.53000000000000003 109.438 171.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.63 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -57.9 -44.54 94.37 Favored Glycine 0 C--O 1.219 -0.79 0 CA-C-N 114.995 -1.002 . . . . 0.69999999999999996 112.276 178.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -52.36 -44.59 65.33 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.906 0.384 . . . . 1.04 111.329 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 60' ' ' ARG . 41.6 mt-10 -67.47 -29.05 68.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.791 -0.641 . . . . 2.29 111.721 179.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.5 ' HE1' ' HA2' ' B' 1012 ' ' GLY . 13.4 m-85 -81.03 -41.96 21.85 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.973 -0.558 . . . . 2.29 111.255 176.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.63 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.0 mt-10 -55.85 -50.02 71.73 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.189 0.519 . . . . 1.3 109.869 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.463 HD12 ' N ' ' A' ' 60' ' ' ARG . 3.8 pp -64.6 -35.05 79.73 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.232 -0.894 . . . . 1.54 110.648 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.463 ' N ' HD12 ' A' ' 59' ' ' LEU . 8.6 ttt180 -70.1 -44.96 67.96 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 120.377 -0.529 . . . . 2.5800000000000001 111.203 -167.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -90.54 -3.75 57.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.294 -0.412 . . . . 5.3200000000000003 111.196 -179.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.529 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 51.2 ttp180 -50.06 -37.23 32.46 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 113.174 0.805 . . . . 4.4800000000000004 113.174 -171.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 -66.97 -38.79 86.74 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.985 0.422 . . . . 4.7199999999999998 110.937 -179.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.666 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.76 -42.82 9.36 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.603 0.964 . . . . 1.1699999999999999 113.603 -172.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.529 ' CD1' ' HA ' ' A' ' 62' ' ' ARG . 8.1 p90 -52.69 -39.13 61.68 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.045 1.128 . . . . 2.8100000000000001 114.045 -161.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.9 t -85.49 -21.74 28.52 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.155 0.502 . . . . 2.1899999999999999 110.066 -175.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -77.46 -31.84 54.07 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.038 -0.727 . . . . 2.7200000000000002 109.038 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.666 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 61.8 mt -63.46 -15.09 56.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.975 -1.011 . . . . 1.5600000000000001 112.032 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.777 HG22 HG13 ' A' ' 74' ' ' ILE . 17.5 p -54.36 -37.06 64.51 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.254 0.55 . . . . 0.69999999999999996 110.474 -177.158 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 67.2 m -61.71 -31.51 71.66 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.063 -0.971 . . . . 1.3400000000000001 111.123 176.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.58 ' NE2' HD22 ' A' ' 68' ' ' LEU . 10.2 mt-30 -80.69 -47.69 13.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.603 -0.726 . . . . 1.4199999999999999 110.224 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.586 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.1 mp -68.1 -31.81 71.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.544 -0.753 . . . . 1.3700000000000001 110.444 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.442 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 50.4 m-70 68.51 64.06 0.34 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.607 0.718 . . . . 2.7200000000000002 109.91 -173.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.777 HG13 HG22 ' A' ' 69' ' ' THR . 26.0 mm -65.02 108.88 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 114.477 -1.238 . . . . 0.91000000000000003 110.594 178.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.738 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.83 -171.49 0.27 Allowed Pre-proline 0 C--N 1.316 -0.869 0 N-CA-C 107.45 -1.315 . . . . 0.51000000000000001 107.45 -169.396 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.738 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.0 Cg_exo -30.91 166.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 124.777 3.652 . . . . 0.46999999999999997 114.766 164.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.489 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.33 -28.87 0.01 OUTLIER Glycine 0 N--CA 1.476 1.353 0 N-CA-C 117.225 1.65 . . . . 0.40000000000000002 117.225 -173.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.46 ' N ' ' O ' ' A' ' 76' ' ' PRO . 31.2 p -68.87 3.46 1.96 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.838 0.819 . . . . 0.56000000000000005 112.0 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.02 -14.51 61.9 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.184 0.516 . . . . 0.34000000000000002 109.675 170.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.452 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 44.0 t80 -75.54 -22.79 56.75 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 115.761 -0.654 . . . . 4.1299999999999999 109.372 174.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.445 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 34.0 mt-30 -82.57 -23.9 34.23 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.625 0.726 . . . . 1.03 109.865 174.093 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 13.7 m -72.68 -53.76 10.86 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 114.557 -1.201 . . . . 0.47999999999999998 109.565 171.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.436 ' HA ' HG23 ' A' ' 86' ' ' VAL . 85.3 t80 -65.79 -17.92 64.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.029 -0.987 . . . . 1.1799999999999999 110.229 175.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.604 ' HA ' HG12 ' A' ' 87' ' ' VAL . 34.7 tt0 -60.9 -49.34 77.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.884 -0.598 . . . . 0.80000000000000004 110.389 177.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -50.6 -34.31 25.42 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.988 -1.006 . . . . 1.6200000000000001 110.622 176.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.596 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 1.8 t -80.63 -51.54 15.64 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 114.646 -1.161 . . . . 1.3 110.602 -176.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.604 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.0 p -63.54 -21.75 29.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.826 0.822 . . . . 0.84999999999999998 109.841 -179.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.2 m-80 -78.53 -45.49 21.76 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.367 -1.288 . . . . 0.91000000000000003 111.615 175.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 1.028 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 16.2 pt-20 -69.57 -32.3 70.98 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 107.961 -1.125 . . . . 2.8700000000000001 107.961 -178.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.596 ' HB2' ' O ' ' A' ' 86' ' ' VAL . 0.2 OUTLIER -60.61 -31.06 70.25 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 113.182 -1.827 . . . . 1.28 111.152 177.983 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.677 ' HA ' HG22 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -99.27 -38.29 8.93 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.07 0.462 . . . . 2.2999999999999998 111.29 -169.533 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.56 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 10.3 ptm180 -72.65 -34.22 67.11 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.652 -0.704 . . . . 5.0599999999999996 110.586 -174.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -89.13 8.63 29.02 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.851 -1.068 . . . . 3.1200000000000001 112.31 -172.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.68 72.52 0.11 Allowed Glycine 0 C--N 1.337 0.618 0 C-N-CA 117.01 -2.519 . . . . 2.3100000000000001 116.15 -179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.874 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 48.8 t -71.1 92.62 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 CA-C-N 119.053 1.427 . . . . 1.0600000000000001 111.361 177.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.434 ' N ' ' ND2' ' A' ' 96' ' ' ASN . 1.1 m120 -114.65 -170.81 1.81 Allowed 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.493 -1.23 . . . . 2.1200000000000001 108.854 178.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.843 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 13.4 m-90 -58.84 -38.0 77.72 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.064 0.459 . . . . 3.3399999999999999 110.865 177.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.967 ' HA3' HG21 ' B' 1015 ' ' ILE . . . -83.47 -32.19 25.66 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.91 -0.662 . . . . 0.68999999999999995 114.536 -170.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.874 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 0.6 OUTLIER -69.1 -30.08 68.3 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 118.078 0.939 . . . . 4.2400000000000002 109.587 -176.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 82.2 mt -69.81 -34.19 59.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.4 0.619 . . . . 0.44 109.53 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.553 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 79.5 t -55.03 -58.66 3.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 114.935 -1.029 . . . . 1.3500000000000001 110.045 168.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -51.39 -41.74 60.92 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.773 -0.649 . . . . 0.44 110.873 176.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -59.78 -54.3 47.9 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.441 -0.799 . . . . 1.49 112.02 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.496 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.4 OUTLIER -72.76 -23.53 60.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.035 0.445 . . . . 3.29 110.435 -176.44 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.558 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 13.3 t -76.32 -53.88 7.57 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 115.794 -0.639 . . . . 1.1899999999999999 110.521 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -66.9 -28.07 68.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.009 0.433 . . . . 2.8900000000000001 109.911 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.487 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -65.72 -44.09 93.0 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.79 -0.641 . . . . 0.29999999999999999 111.71 174.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.889 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.79 -35.27 91.8 Favored Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.461 -0.876 . . . . 0.23000000000000001 111.222 175.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.73 -28.91 65.08 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.556 -0.322 . . . . 0.31 110.81 177.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.417 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.24 -39.62 95.12 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 108.171 -1.048 . . . . 1.1200000000000001 108.171 179.407 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.701 ' SG ' HD21 ' A' ' 17' ' ' LEU . 42.1 t -55.24 -53.04 61.12 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 113.989 -1.46 . . . . 0.26000000000000001 110.735 174.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.798 HG22 ' HD2' ' A' ' 20' ' ' LYS . 65.9 t -63.14 -39.6 85.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.403 -0.362 . . . . 0.34999999999999998 111.852 -177.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.463 ' HB3' HG21 ' A' ' 74' ' ' ILE . 2.5 mm-40 -65.57 -22.89 66.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.058 0.456 . . . . 2.5099999999999998 110.917 178.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.412 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 49.1 m -79.28 -41.34 28.32 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.903 -0.777 . . . . 0.28000000000000003 108.903 175.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.594 HG21 ' CD2' ' A' ' 17' ' ' LEU . 98.0 t -65.42 -32.94 60.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 114.999 -1.0 . . . . 1.23 109.293 179.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.36 -50.55 59.3 Favored 'General case' 0 C--N 1.315 -0.891 0 CA-C-N 113.313 -1.767 . . . . 0.59999999999999998 111.411 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.423 ' HB2' ' HG3' ' A' ' 119' ' ' MET . 10.9 mmtp -87.03 11.07 14.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.829 -0.623 . . . . 1.6200000000000001 110.441 -179.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.549 ' HA ' HE21 ' A' ' 120' ' ' GLN . 39.7 mt-10 66.03 43.56 2.92 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-O 121.662 0.744 . . . . 1.8799999999999999 110.227 -178.075 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.423 ' HG3' ' HB2' ' A' ' 117' ' ' LYS . 26.6 mtm -118.22 48.42 1.42 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.073 -1.084 . . . . 0.31 108.073 178.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.549 HE21 ' HA ' ' A' ' 118' ' ' GLU . 2.4 mt-30 -63.73 -7.27 7.18 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.641 -1.163 . . . . 1.1499999999999999 112.529 -175.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.516 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 34.2 m -65.19 -27.2 41.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 120.708 0.29 . . . . 0.46000000000000002 110.918 174.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.706 HD13 ' HD2' ' A' ' 125' ' ' ARG . 2.9 mm? -72.48 -27.33 62.22 Favored 'General case' 0 CA--C 1.51 -0.562 0 CA-C-N 116.589 -0.278 . . . . 0.26000000000000001 110.684 -179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.68 HG22 ' SG ' ' A' ' 111' ' ' CYS . 70.3 t -44.22 -53.44 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 O-C-N 123.8 0.687 . . . . 0.25 111.938 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.2 -35.69 66.4 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 115.756 -0.656 . . . . 1.3500000000000001 111.393 -178.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.706 ' HD2' HD13 ' A' ' 122' ' ' LEU . 70.8 mtt180 -64.78 -52.53 56.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.827 -0.624 . . . . 2.6699999999999999 110.344 -178.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.592 HG22 ' SD ' ' A' ' 130' ' ' MET . 73.1 mt -54.11 -51.89 42.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.605 -0.725 . . . . 0.23000000000000001 110.785 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.674 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -57.46 -36.34 71.3 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.713 0.292 . . . . 0.28999999999999998 111.417 -178.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -61.27 -58.8 6.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.288 0.566 . . . . 0.28000000000000003 110.67 177.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -64.24 -33.71 76.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.021 -0.99 . . . . 3.9100000000000001 111.49 -176.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.592 ' SD ' HG22 ' A' ' 126' ' ' ILE . 88.8 mtp -61.96 -54.59 39.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.04 0.448 . . . . 1.0800000000000001 110.75 178.333 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.89 94.8 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.798 -0.637 . . . . 0.25 111.086 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 92.0 m -62.75 -43.9 97.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.875 0.369 . . . . 0.40000000000000002 110.776 178.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.573 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 71.8 t80 -56.34 -42.85 78.39 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.226 -0.443 . . . . 3.1299999999999999 110.032 176.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.933 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 4.9 tt -63.36 -48.01 79.72 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.102 -0.703 . . . . 0.94999999999999996 109.102 175.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -49.83 -55.67 13.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.895 -0.593 . . . . 0.46000000000000002 112.59 178.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -83.49 -47.2 11.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.064 0.459 . . . . 0.58999999999999997 111.82 -173.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . 0.573 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 44.3 m-70 -90.92 -51.36 5.39 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 112.756 0.65 . . . . 1.45 112.756 -170.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.933 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -83.23 -46.59 12.49 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 114.515 1.302 . . . . 1.2 114.515 -165.072 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.603 ' HA ' HD12 ' A' ' 142' ' ' ILE . 28.3 tt0 -44.98 -52.42 19.4 Favored Pre-proline 0 CA--C 1.538 0.508 0 N-CA-C 112.432 0.53 . . . . 0.75 112.432 -173.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.619 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.3 Cg_exo -53.38 -53.52 6.49 Favored 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 121.654 1.57 . . . . 0.56000000000000005 111.715 176.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -55.0 -51.11 67.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.583 -0.735 . . . . 1.2 110.347 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.603 HD12 ' HA ' ' A' ' 139' ' ' GLU . 73.6 mt -46.83 -53.89 2.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.823 -0.626 . . . . 0.32000000000000001 111.805 174.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.601 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 77.3 mm-40 -61.95 -29.87 70.53 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.896 -0.593 . . . . 0.56999999999999995 111.725 -178.656 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.619 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.6 mm-40 -64.81 -20.77 66.57 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.78 0.8 . . . . 0.78000000000000003 109.898 175.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.649 HD22 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -104.23 2.26 31.46 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.89 -1.05 . . . . 0.93000000000000005 108.783 -176.652 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 127.1 -54.39 0.77 Allowed Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 114.668 -1.151 . . . . 0.56000000000000005 112.011 177.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.453 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 137.41 -177.75 19.59 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.922 -0.656 . . . . 0.48999999999999999 111.784 -177.439 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.442 ' HE1' HD13 ' A' ' 142' ' ' ILE . 11.8 m0 -68.02 -45.63 73.47 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.179 0.514 . . . . 3.5699999999999998 110.084 -179.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -63.72 -34.57 78.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.458 -0.792 . . . . 1.96 111.123 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.579 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 66.0 m -66.77 -30.66 70.92 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.493 -0.322 . . . . 0.67000000000000004 111.702 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.843 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 86.8 t80 -59.14 -38.54 79.95 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.339 -0.544 . . . . 3.0 109.84 174.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.528 HG12 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -75.83 -25.73 17.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.261 -0.427 . . . . 1.1499999999999999 110.19 177.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.575 ' CG ' ' HA ' ' A' ' 150' ' ' THR . 55.1 mt-10 -55.52 -31.0 61.71 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-O 121.216 0.531 . . . . 1.6699999999999999 109.835 172.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 150' ' ' THR . 0.6 OUTLIER -101.92 -50.67 3.61 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.397 -0.819 . . . . 1.3 110.984 -176.664 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . 0.46 ' CD2' ' HB2' ' A' ' 154' ' ' LEU . 97.9 m-85 -120.69 26.08 9.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.789 -0.641 . . . . 4.2400000000000002 111.653 -170.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.588 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -60.22 164.12 15.21 Favored Glycine 0 C--N 1.317 -0.506 0 CA-C-O 121.733 0.629 . . . . 1.1000000000000001 113.685 -176.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.569 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 29.3 t-20 -53.25 128.06 26.74 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 113.835 -1.182 . . . . 1.29 112.212 -176.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.579 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 6.0 t-20 -66.46 -31.13 71.67 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.924 -0.58 . . . . 2.9900000000000002 111.859 -173.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.463 ' HB3' ' OD1' ' A' ' 157' ' ' ASN . . . -59.59 -30.19 68.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.214 0.531 . . . . 2.52 110.463 176.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -85.44 -40.07 16.82 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.03 -0.532 . . . . 2.8700000000000001 110.029 174.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.579 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -58.61 -47.82 83.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.827 -0.624 . . . . 3.2000000000000002 111.126 178.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.498 ' HA ' ' HB3' ' A' ' 165' ' ' LYS . 28.3 mt-10 -69.08 -24.42 64.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.875 -0.602 . . . . 3.7200000000000002 111.227 179.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 33.2 t -68.0 -34.74 77.09 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.362 -0.607 . . . . 4.1799999999999997 109.362 175.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 27.0 mmm180 -85.48 -6.23 59.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.377 -0.829 . . . . 5.8200000000000003 110.32 177.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.498 ' HB3' ' HA ' ' A' ' 162' ' ' GLU . 35.2 ttpt -99.03 -60.83 1.46 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.264 -0.88 . . . . 4.7699999999999996 110.511 -178.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -69.72 -9.39 62.2 Favored Glycine 0 N--CA 1.444 -0.828 0 CA-C-N 114.867 -1.06 . . . . 5.0999999999999996 113.403 -173.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -55.54 -17.09 4.72 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.88 0.371 . . . . 5.7199999999999998 111.973 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.87 ' HG3' ' HA ' ' A' ' 172' ' ' HIS . 33.8 tt0 -68.53 -6.12 23.48 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.358 0.599 . . . . 5.8799999999999999 110.874 176.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.537 ' O ' ' HD3' ' A' ' 169' ' ' ARG . 0.3 OUTLIER -59.75 -32.87 70.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.831 -0.622 . . . . 7.3399999999999999 110.362 174.831 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -75.05 -44.12 49.48 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.937 0.399 . . . . 6.9699999999999998 110.201 178.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -169.61 159.91 8.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.549 -0.75 . . . . 6.9699999999999998 109.196 177.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . 0.87 ' HA ' ' HG3' ' A' ' 168' ' ' GLU . 36.6 m80 -69.98 152.26 44.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.732 -0.213 . . . . 9.3499999999999996 110.622 -176.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -64.02 103.18 0.57 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.335 0.588 . . . . 11.4 109.648 176.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 38.5 m80 60.14 -166.52 0.19 Allowed 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.422 -0.808 . . . . 11.52 110.042 -171.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 31.3 m170 66.1 21.82 11.16 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.148 0.499 . . . . 14.48 110.713 178.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -72.52 -33.66 67.04 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.104 -0.702 . . . . 15.369999999999999 109.104 177.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 66.1 m-70 -109.71 131.7 54.82 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.612 -0.722 . . . . 16.02 110.482 178.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.538 HD23 ' H ' ' A' ' 178' ' ' LEU . 1.8 pt? -117.17 16.9 14.9 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.369 -0.604 . . . . 17.989999999999998 109.369 174.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -65.8 100.01 0.51 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.109 -0.951 . . . . 19.190000000000001 110.681 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -109.2 -34.75 6.48 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.792 -0.64 . . . . 22.260000000000002 110.019 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -76.13 150.57 37.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.074 -0.512 . . . . 22.510000000000002 110.39 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -95.1 109.8 21.81 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.365 -0.605 . . . . 24.890000000000001 109.365 172.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . 0.516 ' CE1' ' HB3' ' A' ' 185' ' ' HIS . 46.6 t-80 -70.52 112.77 7.04 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.772 -0.649 . . . . 25.579999999999998 110.415 -178.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -103.29 79.3 1.7 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.082 -0.508 . . . . 27.370000000000001 110.22 -177.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . 0.516 ' HB3' ' CE1' ' A' ' 183' ' ' HIS . 52.8 t60 . . . . . 0 C--O 1.244 0.792 0 CA-C-N 115.8 -0.636 . . . . 29.059999999999999 109.48 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.239 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -74.1 -34.23 55.73 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.881 -0.676 . . . . 2.9700000000000002 112.366 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.552 ' O ' HG22 ' B' 1004 ' ' VAL . 57.3 m -136.51 -161.7 1.19 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.688 0.28 . . . . 1.9399999999999999 110.264 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.615 ' O ' ' HD3' ' B' 1006 ' ' ARG . 1.0 OUTLIER 59.93 162.31 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 125.367 1.467 . . . . 1.6299999999999999 111.434 176.584 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 0.875 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . 56.87 3.93 0.85 Allowed Glycine 0 CA--C 1.539 1.577 0 C-N-CA 120.218 -0.992 . . . . 1.2 111.902 -155.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . 0.615 ' HD3' ' O ' ' B' 1004 ' ' VAL . 6.4 mpt_? -133.14 -61.27 0.83 Allowed 'General case' 0 C--O 1.227 -0.111 0 C-N-CA 124.325 1.05 . . . . 2.8799999999999999 110.387 -177.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . 0.606 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -70.32 -49.44 49.4 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.14 -0.936 . . . . 1.3100000000000001 112.593 -169.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.583 ' HB2' ' CD ' ' A' ' 89' ' ' GLU . 2.8 mm? -66.53 -39.82 88.8 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.084 -0.71 . . . . 1.3300000000000001 109.084 -176.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 1.028 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -52.19 -57.46 9.59 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.51 -1.223 . . . . 0.88 110.44 171.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.834 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -69.22 -38.05 78.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 113.905 -1.498 . . . . 1.03 112.276 -172.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.641 ' CE1' ' H14' ' B' 1100 ' ' 33B . 3.9 m-30 -74.77 -24.57 58.71 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.236 -0.438 . . . . 1.6699999999999999 111.084 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . 0.5 ' HA2' ' HE1' ' A' ' 57' ' ' PHE . . . -76.95 -9.84 86.5 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 121.151 -0.547 . . . . 0.78000000000000003 112.937 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 22.1 t70 -66.08 -23.66 66.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.962 0.411 . . . . 1.8999999999999999 111.241 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . 0.421 ' N ' ' C20' ' B' 1100 ' ' 33B . 69.8 m -93.62 94.6 8.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.838 0.351 . . . . 1.4399999999999999 110.961 -175.146 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.967 HG21 ' HA3' ' A' ' 98' ' ' GLY . 22.4 pt -107.49 9.95 9.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.175 -0.466 . . . . 2.9100000000000001 110.987 178.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 17.7 m120 -114.0 -54.59 2.58 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.847 -0.615 . . . . 4.29 109.385 174.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 24.6 ptt180 -127.19 86.1 2.45 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.333 0.587 . . . . 8.1699999999999999 110.278 177.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.53 0 CA-C-N 116.187 -0.46 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.834 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.514 ' HB2' ' OE2' ' A' ' 139' ' ' GLU . 61.8 mtm . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 120.963 0.411 . . . . 6.21 110.084 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.452 ' H ' ' CD ' ' A' ' 139' ' ' GLU . 8.5 m -96.66 129.08 44.12 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.102 -0.703 . . . . 1.8700000000000001 109.102 175.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -86.9 2.27 49.77 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.366 -0.533 . . . . 2.4199999999999999 111.77 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.518 ' HB3' ' OE2' ' A' ' 42' ' ' GLU . 4.8 m -67.6 -30.41 69.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.399 -0.364 . . . . 1.25 110.732 176.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.483 ' ND2' HD22 ' A' ' 134' ' ' LEU . 0.0 OUTLIER -62.3 -15.31 47.05 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.158 0.504 . . . . 1.78 110.109 -178.436 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.704 HH12 ' HA ' ' A' ' 128' ' ' ALA . 24.6 tpp180 -52.99 -49.94 65.16 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 115.368 -0.833 . . . . 1.3999999999999999 110.743 174.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.611 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 42.8 mt-10 -52.6 -52.01 57.22 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.366 -1.288 . . . . 0.68000000000000005 111.873 -174.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.58 HD21 HG11 ' A' ' 46' ' ' VAL . 0.4 OUTLIER -46.42 -45.96 18.34 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 115.163 -0.926 . . . . 1.1599999999999999 110.788 177.656 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.665 HG13 ' HE2' ' A' ' 130' ' ' MET . 70.9 t -68.59 -61.36 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-O 121.253 0.549 . . . . 0.27000000000000002 110.187 178.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 6' ' ' ARG . 63.3 t -51.65 -52.47 21.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 114.917 -1.038 . . . . 0.33000000000000002 112.66 -173.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -58.98 -35.31 72.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.065 -0.516 . . . . 0.58999999999999997 111.105 -176.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.699 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 26.9 t80 -77.35 -38.67 49.79 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 120.561 -0.456 . . . . 1.6100000000000001 111.178 -176.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.811 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.3 mp -59.4 -38.78 81.46 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 119.825 -0.75 . . . . 0.34000000000000002 109.499 175.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.453 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 40.6 t -60.8 -45.67 93.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.369 0.604 . . . . 1.05 110.581 175.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -62.08 -32.56 73.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.275 -0.875 . . . . 1.22 111.037 -178.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.609 ' HA ' ' CE ' ' A' ' 16' ' ' LYS . 4.4 mmpt? -72.46 -43.94 63.02 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 113.102 0.778 . . . . 1.4099999999999999 113.102 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.658 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -64.39 -24.17 67.54 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.76 -0.376 . . . . 1.3500000000000001 111.159 -178.376 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.0 t -58.09 -45.12 87.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.165 -0.47 . . . . 0.93999999999999995 111.554 -178.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -76.87 0.26 21.51 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.05 0.452 . . . . 1.3700000000000001 111.834 -177.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.0 mmmt -109.98 -28.19 8.85 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.816 0.817 . . . . 2.2000000000000002 109.313 -178.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.82 23.26 9.43 Favored Glycine 0 N--CA 1.442 -0.905 0 CA-C-N 114.087 -1.415 . . . . 0.53000000000000003 111.303 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -116.16 166.78 11.64 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.234 -0.483 . . . . 0.76000000000000001 110.395 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.427 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 5.6 t -110.27 147.61 33.52 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.11 -0.496 . . . . 0.52000000000000002 110.048 179.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.453 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -77.35 -47.3 20.28 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.088 -0.505 . . . . 3.3599999999999999 110.192 177.177 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 36.5 m -62.16 -36.13 80.92 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.773 0.286 . . . . 1.3700000000000001 111.773 -178.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.427 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 96.6 mt-30 -55.0 -28.0 48.53 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.864 0.364 . . . . 1.1100000000000001 111.908 -178.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.476 ' O ' ' HB2' ' A' ' 124' ' ' SER . 35.9 m-85 -116.6 -14.93 10.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.353 -0.385 . . . . 1.28 111.512 -175.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.58 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 50.8 m -101.37 153.56 19.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.727 0.775 . . . . 1.8100000000000001 112.581 -176.179 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.436 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.2 t70 -125.8 -10.92 6.68 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.116 -1.402 . . . . 2.3100000000000001 109.766 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.806 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.2 m -46.97 -71.26 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.926 -1.488 . . . . 0.92000000000000004 113.1 -166.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.806 ' H ' HG23 ' A' ' 30' ' ' VAL . 8.1 pt-20 -99.32 1.82 44.85 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.203 -0.666 . . . . 2.7400000000000002 109.203 177.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.436 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.7 tt0 -66.64 -52.91 39.78 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.078 -0.964 . . . . 1.45 111.457 -175.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -103.04 -3.34 26.11 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.488 0.551 . . . . 1.8700000000000001 112.488 -171.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 34' ' ' ARG . 18.4 ptt-85 -155.6 151.14 27.17 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.936 0.398 . . . . 3.3900000000000001 111.182 175.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.6 p -132.32 106.09 7.7 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.467 0.651 . . . . 2.25 111.328 179.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.665 ' HG3' ' H ' ' A' ' 37' ' ' ALA . 12.2 pt-20 -95.64 -65.7 0.96 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.396 -0.82 . . . . 3.3399999999999999 110.35 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.665 ' H ' ' HG3' ' A' ' 36' ' ' GLU . . . -64.61 155.21 82.49 Favored Pre-proline 0 C--N 1.309 -1.179 0 CA-C-N 114.607 -1.178 . . . . 1.9199999999999999 110.467 172.179 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.5 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 32.3 Cg_exo -60.03 178.43 0.4 Allowed 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.111 2.541 . . . . 1.8700000000000001 112.708 176.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.72 -0.21 14.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.352 0.596 . . . . 4.6399999999999997 110.406 179.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.529 ' HA3' ' HB2' ' A' ' 44' ' ' GLU . . . 143.78 70.02 0.02 OUTLIER Glycine 0 N--CA 1.439 -1.123 0 N-CA-C 110.988 -0.845 . . . . 2.1499999999999999 110.988 179.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.635 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.3 OUTLIER -66.14 -71.98 0.18 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 120.711 -0.395 . . . . 1.1200000000000001 110.035 -176.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.64 ' CD ' ' H ' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -91.62 -36.74 13.48 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 122.017 0.913 . . . . 2.02 109.515 171.209 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.793 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 75.0 m -69.07 -23.92 64.09 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 113.772 -1.558 . . . . 1.25 114.595 -165.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.529 ' HB2' ' HA3' ' A' ' 40' ' ' GLY . 33.9 tt0 -56.95 -44.31 82.41 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 119.889 -0.724 . . . . 1.9099999999999999 110.159 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.529 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -75.64 -39.71 57.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.017 0.436 . . . . 0.52000000000000002 110.335 175.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.793 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 60.1 t -54.94 -60.38 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.508 -0.769 . . . . 1.4099999999999999 111.671 178.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.611 ' NZ ' ' HB3' ' A' ' 7' ' ' GLU . 15.1 ptpt -60.07 -34.94 74.12 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.273 -0.64 . . . . 0.67000000000000004 109.273 -178.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.579 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 4.7 mm100 -66.6 -32.47 73.83 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.763 -0.653 . . . . 0.98999999999999999 111.054 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.724 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -81.48 -35.67 30.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.351 0.596 . . . . 0.41999999999999998 110.315 176.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.715 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.5 mp -66.56 -22.92 66.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.49 -0.777 . . . . 1.3300000000000001 111.996 -177.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.579 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.3 ptp180 -86.18 -27.94 24.23 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.106 -0.702 . . . . 2.1699999999999999 109.106 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.715 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.1 mm-40 -70.12 -47.93 59.66 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.653 -1.158 . . . . 1.1000000000000001 109.524 174.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.416 ' HB2' ' HD2' ' A' ' 155' ' ' TYR . . . -68.02 -38.88 83.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.447 -0.797 . . . . 0.53000000000000003 110.268 174.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.68 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -61.84 -42.78 99.78 Favored Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.51 -0.768 . . . . 0.69999999999999996 112.489 -179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -54.08 -44.6 71.29 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.883 0.373 . . . . 1.04 111.04 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.415 ' HA ' ' CD2' ' A' ' 59' ' ' LEU . 37.3 mt-10 -63.38 -29.22 70.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.934 -0.575 . . . . 2.29 111.388 178.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.524 ' HZ ' HD12 ' B' 1008 ' ' LEU . 71.3 t80 -77.5 -39.87 44.82 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.207 -0.451 . . . . 2.29 110.294 177.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.68 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.4 mt-10 -62.81 -46.89 85.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.868 -0.605 . . . . 1.3 111.067 -176.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.514 HD12 ' N ' ' A' ' 60' ' ' ARG . 4.5 pp -59.25 -33.08 70.6 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.215 -0.448 . . . . 1.54 112.028 -175.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.514 ' N ' HD12 ' A' ' 59' ' ' LEU . 5.7 ptp85 -87.34 -35.38 18.42 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.332 -0.547 . . . . 2.5800000000000001 112.353 -174.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.546 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 0.9 OUTLIER -91.63 -5.71 53.42 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 120.732 -0.387 . . . . 5.3200000000000003 111.299 -178.436 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 58' ' ' GLU . 69.2 ttt180 -55.86 -32.5 63.7 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.285 -0.416 . . . . 4.4800000000000004 111.644 -174.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -54.34 -39.35 67.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.837 -0.62 . . . . 4.7199999999999998 111.96 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.409 ' HB1' HD13 ' A' ' 68' ' ' LEU . . . -90.72 -28.83 18.05 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.549 -0.296 . . . . 1.1699999999999999 111.736 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.672 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 28.0 t80 -51.82 -38.55 56.24 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.86 0.689 . . . . 2.8100000000000001 112.86 -172.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.1 p -72.03 -34.83 69.11 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.859 0.318 . . . . 2.1899999999999999 111.859 -176.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -90.43 -32.21 16.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.914 0.388 . . . . 2.7200000000000002 111.226 -175.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.44 ' HA ' ' HG3' ' A' ' 71' ' ' GLN . 3.6 mp -60.51 -17.35 44.98 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 112.864 0.69 . . . . 1.5600000000000001 112.864 -175.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.528 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 3.0 p -58.9 -35.73 73.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 118.794 0.725 . . . . 0.69999999999999996 110.403 -178.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 51.1 m -65.93 -28.59 69.04 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.192 -0.913 . . . . 1.3400000000000001 110.437 175.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.44 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 7.6 mt-30 -86.9 -36.16 18.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.341 -0.845 . . . . 1.4199999999999999 110.249 -177.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.565 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.4 mm? -65.39 -32.53 74.2 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 109.077 -0.712 . . . . 1.3700000000000001 109.077 169.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.466 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 32.7 m80 66.11 39.01 4.49 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.292 -1.003 . . . . 2.7200000000000002 108.292 -173.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.656 HG22 ' HE1' ' A' ' 119' ' ' MET . 29.0 mm -45.18 117.34 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.321 0 CA-C-N 113.634 -1.621 . . . . 0.91000000000000003 112.316 -177.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.762 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.7 -171.34 0.27 Allowed Pre-proline 0 N--CA 1.442 -0.872 0 CA-C-N 114.574 -1.194 . . . . 0.51000000000000001 108.019 -171.078 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.762 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 52.7 Cg_exo -28.62 166.04 0.0 OUTLIER 'Trans proline' 0 C--N 1.364 1.35 0 C-N-CA 125.299 3.999 . . . . 0.46999999999999997 115.628 165.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.46 -30.34 0.01 OUTLIER Glycine 0 N--CA 1.47 0.962 0 N-CA-C 117.449 1.74 . . . . 0.40000000000000002 117.449 -172.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.472 ' HA ' ' CD1' ' A' ' 80' ' ' TYR . 28.2 p -67.07 6.4 0.54 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.942 0.871 . . . . 0.56000000000000005 112.576 -178.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.01 -10.4 57.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.327 0.584 . . . . 0.34000000000000002 110.138 175.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.472 ' CD1' ' HA ' ' A' ' 78' ' ' THR . 4.9 p90 -73.97 -19.1 60.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.761 -0.654 . . . . 4.1299999999999999 109.835 175.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.598 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 25.9 mt-30 -87.48 -18.27 30.25 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.763 0.792 . . . . 1.03 110.288 174.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.1 m -75.88 -53.42 8.46 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 114.663 -1.153 . . . . 0.47999999999999998 108.844 170.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.442 ' CD2' ' HZ3' ' A' ' 129' ' ' TRP . 90.2 t80 -65.66 -15.39 62.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.85 -1.068 . . . . 1.1799999999999999 110.06 174.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.632 ' HA ' HG12 ' A' ' 87' ' ' VAL . 28.7 tt0 -60.78 -49.08 78.91 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-O 121.773 0.797 . . . . 0.80000000000000004 110.111 176.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.454 ' H ' ' HG2' ' A' ' 85' ' ' GLN . 62.8 mm-40 -50.16 -37.58 35.37 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.731 -1.577 . . . . 1.6200000000000001 112.0 -176.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.571 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 3.6 p -91.62 -42.45 13.67 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.227 0 CA-C-N 114.633 -1.167 . . . . 1.3 111.799 -176.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.632 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.9 p -59.71 -24.07 28.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 122.077 0.941 . . . . 0.84999999999999998 109.399 176.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.3 m-80 -71.51 -39.78 70.58 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.037 -1.438 . . . . 0.91000000000000003 111.691 177.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.762 ' HA ' ' HD2' ' A' ' 92' ' ' ARG . 1.6 pp20? -77.9 -32.44 51.76 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.53 0.681 . . . . 2.8700000000000001 109.653 -179.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.619 HD12 HH11 ' A' ' 99' ' ' ARG . 0.2 OUTLIER -61.71 -30.97 71.11 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.214 -1.357 . . . . 1.28 112.008 -165.912 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.409 ' HA ' ' HB ' ' A' ' 95' ' ' VAL . 17.2 p90 -107.41 -30.06 8.89 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.208 0.447 . . . . 2.2999999999999998 112.208 -175.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.762 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -65.27 -22.05 66.8 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.066 0.46 . . . . 5.0599999999999996 111.901 -169.306 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.503 ' N ' ' HD3' ' A' ' 92' ' ' ARG . 28.1 t70 -92.91 -13.86 28.36 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.795 -0.638 . . . . 3.1200000000000001 111.67 -172.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.16 69.78 0.11 Allowed Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 118.862 -1.637 . . . . 2.3100000000000001 112.805 -173.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.562 HG13 ' CD1' ' A' ' 141' ' ' TRP . 0.1 OUTLIER -67.77 109.81 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 122.992 1.377 . . . . 1.0600000000000001 110.499 -173.576 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.422 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 2.8 p30 -108.04 -170.89 1.76 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 113.391 -1.731 . . . . 2.1200000000000001 109.653 179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.97 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 15.8 m-90 -54.9 -42.64 72.41 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.571 -0.74 . . . . 3.3399999999999999 110.664 177.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -77.27 -30.32 54.71 Favored Glycine 0 N--CA 1.452 -0.282 0 CA-C-N 115.909 -0.587 . . . . 0.68999999999999995 113.567 -174.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.754 HH12 ' HA ' ' B' 1009 ' ' ALA . 16.5 mmt180 -59.97 -36.61 77.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.314 0.578 . . . . 4.2400000000000002 111.368 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.472 HG12 ' HG ' ' A' ' 138' ' ' LEU . 94.5 mt -78.0 -32.35 17.4 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 115.601 -0.727 . . . . 0.44 111.895 -173.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.442 HG22 HD13 ' B' 1015 ' ' ILE . 1.6 m -65.16 -22.97 32.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.401 0.619 . . . . 1.3500000000000001 110.197 174.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.75 -42.85 19.22 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.205 0.526 . . . . 0.44 110.049 175.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.422 ' CE1' HG23 ' A' ' 87' ' ' VAL . 22.5 t80 -54.71 -55.11 33.34 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.891 -1.05 . . . . 1.49 111.358 177.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.715 ' CZ ' ' HB3' ' A' ' 50' ' ' LEU . 0.2 OUTLIER -70.87 -20.56 62.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.014 0.435 . . . . 3.29 110.292 -176.501 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.699 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 33.7 t -73.02 -50.61 22.1 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.927 -0.579 . . . . 1.1899999999999999 110.362 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.461 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 18.2 t80 -70.28 -26.8 63.97 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 116.512 -0.313 . . . . 2.8900000000000001 110.216 -178.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.722 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -70.44 -36.03 68.97 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 120.215 -0.993 . . . . 0.29999999999999999 111.38 174.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.811 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -69.22 -33.88 74.32 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 110.855 -0.898 . . . . 0.23000000000000001 110.855 173.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.672 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -69.81 -33.61 72.57 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.136 -0.532 . . . . 0.31 110.643 175.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.595 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -59.19 -39.78 83.67 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 122.253 1.025 . . . . 1.1200000000000001 108.625 -179.723 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.641 ' SG ' HG22 ' A' ' 123' ' ' VAL . 35.6 t -53.0 -53.82 44.4 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 113.622 -1.626 . . . . 0.26000000000000001 110.604 173.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.46 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 93.5 t -65.8 -38.44 82.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.261 -0.427 . . . . 0.34999999999999998 111.07 -178.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.528 ' HG2' ' CG2' ' A' ' 69' ' ' THR . 31.1 mt-10 -56.1 -34.06 65.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.015 0.436 . . . . 2.5099999999999998 110.287 175.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.445 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 45.9 m -74.64 -39.13 62.28 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.412 0.625 . . . . 0.28000000000000003 109.333 178.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 111' ' ' CYS . 91.0 t -66.37 -34.37 69.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.095 -0.957 . . . . 1.23 109.565 -179.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -52.12 -48.89 64.57 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 113.575 -1.648 . . . . 0.59999999999999998 111.196 178.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.41 ' HB2' ' HG3' ' A' ' 119' ' ' MET . 28.7 mmtt -88.05 12.47 13.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.718 -0.674 . . . . 1.6200000000000001 110.419 179.468 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.472 ' HA ' HE21 ' A' ' 120' ' ' GLN . 44.9 mt-10 60.11 46.31 10.78 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.876 0.846 . . . . 1.8799999999999999 110.714 -177.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.656 ' HE1' HG22 ' A' ' 74' ' ' ILE . 27.3 mtm -118.69 45.86 1.96 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.462 -1.244 . . . . 0.31 107.738 178.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.472 HE21 ' HA ' ' A' ' 118' ' ' GLU . 4.5 mt-30 -61.01 -7.28 2.36 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.373 -1.285 . . . . 1.1499999999999999 113.156 -175.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.55 HG23 HD22 ' A' ' 122' ' ' LEU . 28.3 m -66.61 -25.8 35.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 O-C-N 122.025 -0.422 . . . . 0.46000000000000002 111.197 173.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.772 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.4 mm? -71.91 -27.05 62.57 Favored 'General case' 0 CA--C 1.509 -0.602 0 N-CA-C 110.268 -0.271 . . . . 0.26000000000000001 110.268 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.641 HG22 ' SG ' ' A' ' 111' ' ' CYS . 60.7 t -43.48 -53.6 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 123.777 0.673 . . . . 0.25 112.184 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.58 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 4.8 t -75.11 -34.62 61.73 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.749 -0.38 . . . . 1.3500000000000001 110.542 -179.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.772 ' HD2' HD13 ' A' ' 122' ' ' LEU . 82.4 mtt180 -63.83 -51.6 63.93 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.243 -0.435 . . . . 2.6699999999999999 110.787 -177.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.65 ' O ' ' HB2' ' A' ' 130' ' ' MET . 89.7 mt -54.52 -47.79 70.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.878 -0.601 . . . . 0.23000000000000001 110.663 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.663 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.93 -25.53 57.71 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.239 -0.437 . . . . 0.28999999999999998 111.962 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.704 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -68.75 -67.03 0.5 Allowed 'General case' 0 CA--C 1.508 -0.644 0 CA-C-O 121.117 0.484 . . . . 0.28000000000000003 110.356 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.634 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 37.6 p-90 -75.69 -17.28 60.0 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.318 -0.855 . . . . 3.9100000000000001 111.809 -176.132 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.722 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 0.3 OUTLIER -65.09 -44.68 88.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.0 0.428 . . . . 1.0800000000000001 109.977 173.143 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.474 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -72.65 -38.87 67.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.385 -0.371 . . . . 0.25 110.125 176.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.597 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 38.0 m -59.76 -45.25 92.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.064 -0.517 . . . . 0.40000000000000002 111.678 175.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.429 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 0.7 OUTLIER -56.11 -41.24 74.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.807 0.337 . . . . 3.1299999999999999 110.578 177.693 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.788 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.4 tt -62.52 -50.54 70.98 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.864 -0.791 . . . . 0.94999999999999996 108.864 173.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . 0.427 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 5.2 m-80 -51.26 -48.57 62.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.879 -0.6 . . . . 0.46000000000000002 112.398 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -80.99 -50.42 9.72 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.294 0.479 . . . . 0.58999999999999997 112.294 -175.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . 0.429 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 1.7 m80 -90.64 -51.58 5.32 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.656 0.613 . . . . 1.45 112.656 -171.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.788 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -81.47 -46.98 13.76 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.612 0.968 . . . . 1.2 113.612 -168.644 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.768 ' HA ' HD12 ' A' ' 142' ' ' ILE . 34.1 tt0 -44.19 -52.92 14.94 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 113.259 0.837 . . . . 0.75 113.259 -172.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.6 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 38.8 Cg_exo -59.5 -44.23 33.97 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 121.647 1.565 . . . . 0.56000000000000005 111.529 178.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . 0.562 ' CD1' HG13 ' A' ' 95' ' ' VAL . 1.5 t-105 -63.79 -42.93 97.63 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.48 -0.782 . . . . 1.2 110.203 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.768 HD12 ' HA ' ' A' ' 139' ' ' GLU . 49.5 mt -48.68 -50.25 13.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.053 0.454 . . . . 0.32000000000000001 111.128 173.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.5 mm-40 -59.96 -31.79 70.21 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.521 -0.763 . . . . 0.56999999999999995 111.46 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.2 mm-40 -65.14 -19.42 65.97 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.599 0.714 . . . . 0.78000000000000003 110.733 176.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 19.8 m-80 -111.16 5.14 19.85 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.198 -0.91 . . . . 0.93000000000000005 110.408 -175.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 117.17 -42.26 1.9 Allowed Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.626 -0.715 . . . . 0.56000000000000005 113.071 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.583 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 132.8 -176.2 19.61 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.369 -0.92 . . . . 0.48999999999999999 112.343 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.678 ' HZ2' ' HG3' ' A' ' 139' ' ' GLU . 12.9 m-90 -73.16 -47.24 45.51 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.046 0.451 . . . . 3.5699999999999998 110.495 -177.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -59.85 -41.42 91.36 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.654 -0.703 . . . . 1.96 110.494 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.594 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 86.3 m -56.1 -35.22 66.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.924 -0.58 . . . . 0.67000000000000004 111.404 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.97 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 64.4 t80 -61.1 -45.12 96.0 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.875 -0.33 . . . . 3.0 110.202 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.591 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -70.49 -24.6 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.474 0.654 . . . . 1.1499999999999999 109.869 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -66.81 -22.99 66.0 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.276 -0.42 . . . . 1.6699999999999999 110.403 173.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.1 mt -98.03 -55.84 2.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.296 0.57 . . . . 1.3 110.88 178.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . 0.416 ' HD2' ' HB2' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -121.7 27.41 8.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.439 -0.8 . . . . 4.2400000000000002 110.416 -170.712 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.724 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -58.14 167.0 6.21 Favored Glycine 0 CA--C 1.503 -0.709 0 CA-C-O 121.834 0.686 . . . . 1.1000000000000001 114.24 -178.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.715 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 28.5 t-20 -54.43 130.01 37.89 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 113.68 -1.26 . . . . 1.29 111.224 -177.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.716 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 4.1 m120 -65.39 -28.39 69.23 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.502 0.556 . . . . 2.9900000000000002 112.502 -173.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.453 ' HB3' ' OD1' ' A' ' 157' ' ' ASN . . . -60.56 -29.41 69.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.163 0.506 . . . . 2.52 110.32 176.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -87.06 -36.68 18.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.099 -0.501 . . . . 2.8700000000000001 110.206 174.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.541 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -59.77 -50.57 73.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.891 -0.595 . . . . 3.2000000000000002 111.354 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.716 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 9.2 pt-20 -60.27 -27.5 67.3 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.637 -0.256 . . . . 3.7200000000000002 111.378 176.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 18.1 t -67.77 -40.55 84.01 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.629 -0.508 . . . . 4.1799999999999997 109.629 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 4.6 mpt_? -80.89 -0.32 38.62 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 121.203 0.525 . . . . 5.8200000000000003 110.52 176.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.402 ' HB3' ' O ' ' A' ' 162' ' ' GLU . 38.9 ttmt -86.85 -13.59 44.52 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.979 -0.555 . . . . 4.7699999999999996 109.763 176.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -63.82 -17.77 61.04 Favored Glycine 0 N--CA 1.451 -0.303 0 CA-C-N 115.642 -0.708 . . . . 5.0999999999999996 113.325 -174.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -69.53 -20.88 63.69 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 122.603 -0.351 . . . . 5.7199999999999998 111.172 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.56 ' HA ' ' O ' ' A' ' 171' ' ' GLU . 25.8 mt-10 -81.23 2.92 25.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.957 0.408 . . . . 5.8799999999999999 110.686 178.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.428 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 3.5 tmt_? -64.91 -39.74 93.98 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.53 -0.915 . . . . 7.3399999999999999 108.53 173.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.448 HD22 ' HA ' ' A' ' 170' ' ' LEU . 0.3 OUTLIER -106.0 -47.78 3.77 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.463 -0.789 . . . . 6.9699999999999998 109.932 176.707 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . 0.56 ' O ' ' HA ' ' A' ' 168' ' ' GLU . 40.5 mm-40 -89.07 91.6 8.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.342 0.592 . . . . 6.9699999999999998 111.455 -177.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 63.7 t60 -166.12 24.27 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.551 -0.907 . . . . 9.3499999999999996 108.551 -178.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 30.3 t-80 -133.34 30.06 3.91 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.389 -0.823 . . . . 11.4 110.278 -174.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 9.1 t-160 -65.75 -28.92 69.39 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.988 0.423 . . . . 11.52 110.061 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 31.9 m80 -113.78 153.82 28.42 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.106 -0.497 . . . . 14.48 110.227 174.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -83.4 118.99 24.09 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.008 -0.542 . . . . 15.369999999999999 109.778 178.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -104.71 107.18 17.99 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.516 -0.311 . . . . 16.02 110.606 -177.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 78.3 mt 62.67 -174.04 0.15 Allowed 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.582 -0.736 . . . . 17.989999999999998 111.291 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -97.51 -6.94 32.54 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.054 0.454 . . . . 19.190000000000001 110.234 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -92.94 109.76 21.21 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.928 -0.578 . . . . 22.260000000000002 110.068 178.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -79.91 -51.3 9.29 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.083 -0.508 . . . . 22.510000000000002 110.418 -177.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 64.45 87.61 0.11 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.542 -0.754 . . . . 24.890000000000001 110.503 -179.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 82.1 t60 -109.95 92.16 3.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.15 -0.477 . . . . 25.579999999999998 110.112 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 59.2 t60 -116.91 -17.02 10.51 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.016 -0.538 . . . . 27.370000000000001 110.139 -178.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 . . . . . 0 C--O 1.247 0.962 0 CA-C-O 118.454 -0.784 . . . . 29.059999999999999 110.125 179.482 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.109 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . 87.35 -87.34 1.54 Allowed Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.615 -0.802 . . . . 2.9700000000000002 111.916 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.436 ' HA ' ' C2 ' ' B' 1100 ' ' 33B . 4.6 m 56.78 -149.32 0.47 Allowed 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 122.957 0.503 . . . . 1.9399999999999999 111.835 176.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.736 ' HA ' ' CD2' ' B' 1008 ' ' LEU . 2.7 m 39.72 -88.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.344 0.353 0 C-N-CA 124.961 1.304 . . . . 1.6299999999999999 113.578 176.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 0.509 ' H ' HG23 ' B' 1004 ' ' VAL . . . -33.91 -33.48 0.02 OUTLIER Glycine 0 CA--C 1.536 1.405 0 CA-C-N 117.989 0.359 . . . . 1.2 113.977 165.41 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . 0.419 ' O ' ' HB3' ' B' 1009 ' ' ALA . 18.4 mmt180 -107.38 -37.04 6.34 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.672 0.619 . . . . 2.8799999999999999 112.672 177.358 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . 0.581 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -71.34 -61.6 1.71 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.884 0.698 . . . . 1.3100000000000001 112.884 -165.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.736 ' CD2' ' HA ' ' B' 1004 ' ' VAL . 1.9 mm? -61.86 -41.96 98.47 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.138 -0.689 . . . . 1.3300000000000001 109.138 -177.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 0.754 ' HA ' HH12 ' A' ' 99' ' ' ARG . . . -38.48 -56.87 1.22 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.333 -1.303 . . . . 0.88 111.645 169.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.739 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -73.51 -42.58 61.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.535 -1.211 . . . . 1.03 112.005 -174.003 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.611 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 31.0 m-85 -70.86 -20.79 62.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.062 -0.517 . . . . 1.6699999999999999 111.476 -177.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -75.52 -23.39 73.31 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.841 -0.695 . . . . 0.78000000000000003 112.928 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 28.7 t70 -61.75 -19.51 62.53 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.988 0.423 . . . . 1.8999999999999999 111.09 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 18.6 m -87.03 -14.4 41.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.335 -0.393 . . . . 1.4399999999999999 111.2 -173.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.442 HD13 HG22 ' A' ' 101' ' ' VAL . 56.8 mt -76.1 -70.56 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 110.008 -0.367 . . . . 2.9100000000000001 110.008 -178.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -124.52 95.73 4.64 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.157 -0.474 . . . . 4.29 109.835 176.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 13.1 tpt180 -91.13 -71.78 0.61 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.033 -0.531 . . . . 8.1699999999999999 110.376 178.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 116.697 -0.228 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.753 ' O62' ' C2 ' ' B' 1100 ' ' 33B . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.657 ' HG3' HG21 ' A' ' 41' ' ' THR . 26.5 mmt . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 109.828 -0.434 . . . . 6.21 109.828 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.0 t -132.82 -24.09 1.97 Allowed 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.924 -0.31 . . . . 1.8700000000000001 111.441 -179.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.7 tp60 -100.38 1.19 41.17 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.333 0.587 . . . . 2.4199999999999999 110.714 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.5 p -71.12 -12.33 61.44 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.975 -0.557 . . . . 1.25 111.388 -179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.893 ' HA ' HD22 ' A' ' 8' ' ' LEU . 3.4 p30 -66.29 -25.39 66.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.817 -0.628 . . . . 1.78 111.043 176.283 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.641 ' NH1' ' HB ' ' A' ' 30' ' ' VAL . 15.0 tpp85 -55.62 -50.37 70.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.933 -0.576 . . . . 1.3999999999999999 110.618 175.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.471 ' OE1' ' HA2' ' A' ' 40' ' ' GLY . 34.7 mt-10 -59.41 -49.51 77.53 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.444 -0.798 . . . . 0.68000000000000005 111.007 -176.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.893 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.1 OUTLIER -47.73 -39.45 17.75 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.102 -0.954 . . . . 1.1599999999999999 111.287 176.874 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.3 t -73.13 -62.08 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.122 0.487 . . . . 0.27000000000000002 110.253 176.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 6' ' ' ARG . 86.1 t -49.88 -49.15 21.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.17 -0.923 . . . . 0.33000000000000002 113.092 -176.288 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -53.72 -37.21 63.09 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.797 0.332 . . . . 0.58999999999999997 110.845 -176.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.608 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 21.5 t80 -78.47 -44.2 25.18 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.293 -0.412 . . . . 1.6100000000000001 111.007 -178.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.809 HD22 ' HB2' ' A' ' 127' ' ' ALA . 6.1 mp -58.03 -42.7 85.88 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 120.435 -0.506 . . . . 0.34000000000000002 109.905 177.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.1 t -58.95 -44.91 91.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.79 -0.641 . . . . 1.05 110.594 177.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.438 ' O ' ' HB3' ' A' ' 18' ' ' SER . 61.3 t80 -69.18 -29.61 67.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.971 -0.559 . . . . 1.22 110.844 -178.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.67 ' HE2' ' HA ' ' A' ' 16' ' ' LYS . 9.5 mmpt? -74.58 -32.24 62.32 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 120.666 0.27 . . . . 1.4099999999999999 110.879 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.619 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.1 OUTLIER -68.4 -28.17 66.86 Favored 'General case' 0 C--N 1.317 -0.811 0 C-N-CA 120.283 -0.567 . . . . 1.3500000000000001 109.626 174.737 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.438 ' HB3' ' O ' ' A' ' 15' ' ' TYR . 45.1 t -62.5 -36.17 81.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.651 -0.704 . . . . 0.93999999999999995 112.06 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -79.07 -0.01 29.71 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.367 0.604 . . . . 1.3700000000000001 111.243 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.609 ' HB2' ' HD1' ' A' ' 22' ' ' TYR . 19.9 mmmt -112.97 -28.66 7.63 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.783 0.801 . . . . 2.2000000000000002 109.09 178.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.36 21.1 11.02 Favored Glycine 0 N--CA 1.443 -0.856 0 CA-C-N 114.119 -1.401 . . . . 0.53000000000000003 111.569 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.609 ' HD1' ' HB2' ' A' ' 20' ' ' LYS . 94.4 m-85 -110.2 167.24 10.34 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.571 -0.314 . . . . 0.76000000000000001 110.24 178.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.586 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 6.6 t -111.47 149.97 30.56 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.034 0.445 . . . . 0.52000000000000002 110.866 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.588 ' HZ2' ' HG2' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -65.47 -50.4 65.48 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.474 -0.785 . . . . 3.3599999999999999 110.379 173.555 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.9 t -70.42 -24.63 62.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 1.3700000000000001 111.588 -172.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.586 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 92.7 mt-30 -57.7 -32.29 67.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.006 0.432 . . . . 1.1100000000000001 110.997 177.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.512 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 16.4 m-85 -114.76 -16.44 11.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.1 -0.5 . . . . 1.28 111.674 -173.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.608 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 24.8 m -100.97 152.04 21.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.721 0.772 . . . . 1.8100000000000001 112.661 -175.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.476 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 2.7 t70 -127.81 -8.69 5.54 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.244 -1.344 . . . . 2.3100000000000001 109.842 -177.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.819 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.3 m -51.39 -72.88 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 114.196 -1.365 . . . . 0.92000000000000004 113.041 -169.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.819 ' H ' HG23 ' A' ' 30' ' ' VAL . 1.7 pm0 -100.57 3.04 42.38 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.089 0.471 . . . . 2.7400000000000002 110.337 174.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.476 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 19.7 tt0 -58.25 -53.75 54.75 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.618 -0.719 . . . . 1.45 111.324 178.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -87.11 -58.98 2.38 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.818 -0.628 . . . . 1.8700000000000001 111.445 -172.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.0 ptt180 -98.96 141.5 31.65 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.985 0.422 . . . . 3.3900000000000001 109.881 175.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 4.2 p -117.54 98.87 6.62 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 121.711 0.767 . . . . 2.25 110.942 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 1.004 ' HG3' ' H ' ' A' ' 37' ' ' ALA . 11.2 pt-20 -93.29 -72.3 0.61 Allowed 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 114.624 -1.171 . . . . 3.3399999999999999 110.496 -176.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 1.004 ' H ' ' HG3' ' A' ' 36' ' ' GLU . . . -63.54 162.73 24.5 Favored Pre-proline 0 C--N 1.308 -1.202 0 CA-C-N 114.119 -1.401 . . . . 1.9199999999999999 112.164 178.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.769 ' HG3' ' HB ' ' A' ' 41' ' ' THR . 47.7 Cg_endo -64.25 -178.98 0.71 Allowed 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 124.622 3.548 . . . . 1.8700000000000001 112.89 176.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -87.21 -5.49 58.95 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.868 -0.79 . . . . 4.6399999999999997 108.868 168.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.667 ' H ' ' HB2' ' A' ' 38' ' ' PRO . . . 156.29 72.91 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.785 0 CA-C-N 114.947 -1.024 . . . . 2.1499999999999999 111.771 -179.211 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.958 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.8 t -60.88 -74.42 0.08 Allowed 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 109.961 -0.385 . . . . 1.1200000000000001 109.961 -177.054 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.958 ' H ' HG23 ' A' ' 41' ' ' THR . 11.2 pt-20 -94.98 -29.05 14.83 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 122.96 1.362 . . . . 2.02 108.211 164.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.59 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.0 OUTLIER -62.91 -26.3 68.73 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 112.021 -2.354 . . . . 1.25 114.107 -166.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.583 ' HB2' ' HA3' ' A' ' 40' ' ' GLY . 42.2 tt0 -55.56 -42.23 74.4 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.918 -0.313 . . . . 1.9099999999999999 110.411 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.542 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -79.48 -37.33 37.03 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.97 0.414 . . . . 0.52000000000000002 110.354 176.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.673 ' HA ' ' CG1' ' A' ' 152' ' ' VAL . 99.7 t -58.11 -60.96 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.683 -0.69 . . . . 1.4099999999999999 111.353 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.476 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 10.6 ptpt -59.41 -34.62 72.69 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.365 -0.605 . . . . 0.67000000000000004 109.365 -178.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.531 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 4.7 mm100 -66.59 -32.44 73.78 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.439 -0.801 . . . . 0.98999999999999999 111.01 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.762 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -82.88 -35.02 26.55 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.303 0.573 . . . . 0.41999999999999998 110.3 176.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.451 HD12 ' CE2' ' A' ' 151' ' ' PHE . 1.1 tp -63.06 -31.38 72.51 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.245 -0.889 . . . . 1.3300000000000001 111.468 -177.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.531 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 9.5 ptp180 -79.05 -30.24 43.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.661 0.743 . . . . 2.1699999999999999 109.098 -178.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.647 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.4 mm-40 -68.9 -47.93 64.59 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.58 -1.191 . . . . 1.1000000000000001 109.799 177.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.2 -36.8 82.49 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.427 -0.806 . . . . 0.53000000000000003 110.073 174.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.707 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.73 -44.05 98.4 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.46 -0.791 . . . . 0.69999999999999996 112.144 179.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.447 ' O ' HD22 ' A' ' 59' ' ' LEU . 23.9 t70 -55.2 -39.65 69.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.785 0.326 . . . . 1.04 110.774 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.41 ' O ' HD21 ' A' ' 59' ' ' LEU . 57.3 mm-40 -65.38 -26.45 68.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.36 -0.836 . . . . 2.29 111.658 178.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -82.84 -33.51 27.09 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.516 -0.311 . . . . 2.29 111.205 175.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.772 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 38.2 mt-10 -69.4 -53.37 19.76 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 112.374 0.509 . . . . 1.3 112.374 -165.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.533 ' N ' HD23 ' A' ' 59' ' ' LEU . 2.3 pt? -52.31 -35.18 49.99 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 123.608 0.568 . . . . 1.54 110.477 -177.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 75.7 mtt180 -61.4 -58.86 6.48 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 115.424 -0.807 . . . . 2.5800000000000001 112.055 -178.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.772 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 8.9 p90 -91.32 -6.57 52.9 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.028 0.381 . . . . 5.3200000000000003 112.028 -173.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 58' ' ' GLU . 17.7 tpp85 -62.84 -30.77 71.75 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.95 0.352 . . . . 4.4800000000000004 111.95 -171.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -65.16 -39.88 93.56 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.907 0.384 . . . . 4.7199999999999998 110.196 178.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.432 ' HB1' ' CD1' ' A' ' 68' ' ' LEU . . . -77.21 -41.27 41.98 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.025 -0.534 . . . . 1.1699999999999999 110.858 176.563 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.683 ' CZ ' ' HB1' ' A' ' 109' ' ' ALA . 39.4 t80 -43.42 -47.94 7.06 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.959 0.725 . . . . 2.8100000000000001 112.959 -174.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.3 p -60.01 -37.17 78.95 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.785 0.326 . . . . 2.1899999999999999 111.627 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -86.49 -29.62 22.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.311 0.576 . . . . 2.7200000000000002 110.642 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.432 ' CD1' ' HB1' ' A' ' 64' ' ' ALA . 2.0 mp -59.73 -16.87 30.44 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 115.27 -0.877 . . . . 1.5600000000000001 112.596 -177.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.487 HG22 HG13 ' A' ' 74' ' ' ILE . 2.2 p -57.88 -27.81 63.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.839 0.291 . . . . 0.69999999999999996 111.686 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -71.99 -33.75 68.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.652 0.739 . . . . 1.3400000000000001 109.327 174.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -77.03 -38.39 52.97 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.123 -0.944 . . . . 1.4199999999999999 110.036 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.708 HD21 ' HZ ' ' A' ' 106' ' ' PHE . 3.1 mm? -65.87 -32.87 74.63 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.559 -0.292 . . . . 1.3700000000000001 110.514 172.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 59.7 m80 63.25 41.08 8.17 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.332 -0.988 . . . . 2.7200000000000002 108.332 -172.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.644 HG22 ' HE1' ' A' ' 119' ' ' MET . 31.5 mm -46.71 115.22 0.24 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 113.975 -1.466 . . . . 0.91000000000000003 112.057 -177.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.725 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.15 -174.83 0.45 Allowed Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 114.746 -1.115 . . . . 0.51000000000000001 108.117 -168.234 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.725 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 23.4 Cg_exo -30.3 166.21 0.0 OUTLIER 'Trans proline' 0 C--N 1.361 1.209 0 C-N-CA 125.166 3.911 . . . . 0.46999999999999997 115.001 165.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.595 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -28.82 -34.01 0.01 OUTLIER Glycine 0 N--CA 1.469 0.895 0 N-CA-C 116.931 1.532 . . . . 0.40000000000000002 116.931 -170.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.448 ' N ' ' O ' ' A' ' 76' ' ' PRO . 22.2 p -62.32 3.87 0.17 Allowed 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.893 0.701 . . . . 0.56000000000000005 112.893 -179.383 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.54 -13.16 62.19 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.207 0.527 . . . . 0.34000000000000002 109.927 172.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.595 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 10.5 p90 -75.91 -18.29 59.44 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.526 -0.546 . . . . 4.1299999999999999 109.526 174.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.462 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 24.2 mt-30 -77.57 -32.55 53.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.878 0.847 . . . . 1.03 109.135 172.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.9 m -68.37 -52.28 34.89 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.283 -1.326 . . . . 0.47999999999999998 109.797 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -68.99 -17.97 63.99 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.046 -0.979 . . . . 1.1799999999999999 110.349 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.57 ' HA ' HG12 ' A' ' 87' ' ' VAL . 44.3 tt0 -64.47 -48.78 73.97 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 116.02 -0.536 . . . . 0.80000000000000004 110.502 177.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.469 ' OE1' HG21 ' B' 1004 ' ' VAL . 56.8 mt-30 -46.48 -35.45 5.67 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.715 -1.13 . . . . 1.6200000000000001 110.302 176.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.742 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.4 t -81.47 -54.82 9.21 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.018 0 CA-C-N 114.455 -1.248 . . . . 1.3 111.069 -176.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.57 HG12 ' HA ' ' A' ' 84' ' ' GLU . 10.6 p -58.11 -26.39 29.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.591 0.71 . . . . 0.84999999999999998 109.567 -178.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.489 ' O ' ' HB3' ' A' ' 92' ' ' ARG . 2.3 m-80 -68.07 -40.87 82.65 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.521 -1.218 . . . . 0.91000000000000003 111.833 175.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.951 ' HG2' ' HA2' ' B' 1005 ' ' GLY . 0.3 OUTLIER -79.41 -33.54 42.59 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-O 121.691 0.758 . . . . 2.8700000000000001 109.756 179.259 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.697 ' HA ' ' NH1' ' A' ' 99' ' ' ARG . 42.3 mt -68.31 -22.22 64.72 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-N 114.392 -1.277 . . . . 1.28 112.146 -168.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.556 ' HD1' ' O ' ' A' ' 87' ' ' VAL . 6.2 p90 -108.75 -24.76 11.16 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.719 -0.392 . . . . 2.2999999999999998 111.93 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.639 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -68.45 -25.69 65.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.823 0.344 . . . . 5.0599999999999996 111.685 -171.719 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.435 ' HB2' ' NE ' ' A' ' 92' ' ' ARG . 26.8 t70 -97.61 -1.27 44.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.198 -0.456 . . . . 3.1200000000000001 111.945 -170.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.03 67.86 0.11 Allowed Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 118.847 -1.644 . . . . 2.3100000000000001 113.335 -176.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.594 HG13 ' CD1' ' A' ' 141' ' ' TRP . 0.2 OUTLIER -70.54 100.61 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 123.045 1.402 . . . . 1.0600000000000001 110.85 -177.485 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.51 ' ND2' ' H ' ' A' ' 96' ' ' ASN . 0.2 OUTLIER -110.19 -171.53 1.85 Allowed 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 113.124 -1.853 . . . . 2.1200000000000001 108.782 172.108 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.691 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 16.0 m-90 -46.09 -52.37 12.17 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.732 0.645 . . . . 3.3399999999999999 110.964 178.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.43 ' HA3' HD13 ' B' 1015 ' ' ILE . . . -65.43 -28.14 73.26 Favored Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.362 -0.835 . . . . 0.68999999999999995 114.414 -175.104 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.747 HH12 ' HA ' ' B' 1009 ' ' ALA . 12.7 mmt180 -72.22 -38.0 69.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.156 0.478 . . . . 4.2400000000000002 111.176 -175.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.555 HG12 ' HG ' ' A' ' 138' ' ' LEU . 94.1 mt -70.29 -33.06 52.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.725 -0.67 . . . . 0.44 110.404 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 97' ' ' TRP . 47.0 t -56.31 -54.59 26.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.356 -0.838 . . . . 1.3500000000000001 109.935 170.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -51.1 -47.58 61.9 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.774 -0.648 . . . . 0.44 111.013 176.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.539 ' HA ' HD13 ' A' ' 90' ' ' LEU . 11.3 t80 -55.3 -53.1 60.43 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.939 -1.028 . . . . 1.49 111.993 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.569 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 0.2 OUTLIER -76.6 -21.85 55.02 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.794 -0.362 . . . . 3.29 110.685 -175.033 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.608 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 47.1 t -70.08 -54.66 12.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.236 -0.438 . . . . 1.1899999999999999 110.615 177.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.708 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 41.9 t80 -64.31 -26.6 68.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.039 0.447 . . . . 2.8900000000000001 109.873 178.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.499 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -69.72 -46.96 51.44 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.809 -0.632 . . . . 0.29999999999999999 112.653 178.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.804 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -60.42 -33.46 81.23 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.36 -0.924 . . . . 0.23000000000000001 110.942 175.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.683 ' HB1' ' CZ ' ' A' ' 65' ' ' PHE . . . -72.11 -30.46 65.09 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.023 -0.589 . . . . 0.31 111.01 176.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.7 -42.42 99.63 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 108.731 -0.84 . . . . 1.1200000000000001 108.731 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.645 ' SG ' HG13 ' A' ' 123' ' ' VAL . 32.9 t -50.32 -53.22 30.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.915 -1.493 . . . . 0.26000000000000001 110.933 174.054 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.47 HG11 ' HD3' ' A' ' 20' ' ' LYS . 53.1 t -62.52 -44.64 99.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.884 -0.598 . . . . 0.34999999999999998 111.962 -176.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.537 ' HB3' HG21 ' A' ' 74' ' ' ILE . 21.2 mm-40 -60.79 -26.04 66.98 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.929 0.395 . . . . 2.5099999999999998 111.381 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.501 ' HB3' ' HB2' ' A' ' 122' ' ' LEU . 23.7 m -73.35 -38.51 65.72 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.617 -0.883 . . . . 0.28000000000000003 108.617 174.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 111' ' ' CYS . 88.2 t -68.73 -37.36 77.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.257 -0.883 . . . . 1.23 109.479 -178.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -55.78 -51.02 68.84 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 113.531 -1.668 . . . . 0.59999999999999998 111.516 -177.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' A' ' 113' ' ' GLU . 15.0 mmtt -85.79 15.89 4.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.937 -0.574 . . . . 1.6200000000000001 110.071 -178.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.527 ' HA ' HE21 ' A' ' 120' ' ' GLN . 38.4 mt-10 65.19 48.32 2.22 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.524 -0.762 . . . . 1.8799999999999999 110.832 178.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.644 ' HE1' HG22 ' A' ' 74' ' ' ILE . 25.5 mtm -128.15 43.36 3.15 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.044 -1.095 . . . . 0.31 108.044 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.613 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 1.6 mt-30 -61.47 -7.69 3.4 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.976 -1.011 . . . . 1.1499999999999999 113.131 -175.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.55 HG23 HD22 ' A' ' 122' ' ' LEU . 25.6 m -66.5 -24.78 33.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 122.042 -0.411 . . . . 0.46000000000000002 111.079 174.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.643 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -71.7 -27.02 62.74 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 116.537 -0.301 . . . . 0.26000000000000001 110.19 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.645 HG13 ' SG ' ' A' ' 111' ' ' CYS . 65.5 t -45.97 -54.03 2.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 123.735 0.647 . . . . 0.25 112.116 -179.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.608 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 3.4 t -74.95 -26.02 59.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.901 0.381 . . . . 1.3500000000000001 110.491 -177.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.643 ' HD2' HD13 ' A' ' 122' ' ' LEU . 91.4 mtt180 -71.5 -53.15 14.85 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.337 -0.392 . . . . 2.6699999999999999 110.002 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.528 HD12 ' HA ' ' A' ' 111' ' ' CYS . 76.2 mt -54.46 -50.39 58.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.594 -0.73 . . . . 0.23000000000000001 111.532 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.809 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -57.13 -37.07 71.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.871 0.367 . . . . 0.28999999999999998 110.967 179.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -61.52 -56.96 14.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.701 0.762 . . . . 0.28000000000000003 110.241 175.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.534 ' CZ2' ' HB3' ' A' ' 125' ' ' ARG . 36.4 m0 -56.79 -46.51 81.49 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.148 -1.387 . . . . 3.9100000000000001 110.754 -178.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.574 ' SD ' HD11 ' A' ' 13' ' ' LEU . 88.6 mtp -59.36 -54.07 51.0 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.985 -0.552 . . . . 1.0800000000000001 111.459 -177.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.78 -34.24 75.52 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.044 -0.526 . . . . 0.25 110.318 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 54.9 m -65.81 -48.82 70.43 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.186 -0.461 . . . . 0.40000000000000002 111.004 175.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.493 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 6.5 m-85 -54.56 -42.58 71.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.438 -0.346 . . . . 3.1299999999999999 110.471 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.801 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.7 tt -61.59 -50.53 72.21 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 109.029 -0.73 . . . . 0.94999999999999996 109.029 173.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 4.2 m-80 -50.51 -56.44 11.61 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.247 0.462 . . . . 0.46000000000000002 112.247 179.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.49 -48.23 15.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.069 0.461 . . . . 0.58999999999999997 111.866 -171.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . 0.493 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 52.4 m-70 -90.49 -51.49 5.38 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 112.7 0.63 . . . . 1.45 112.7 -170.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.801 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -86.07 -42.59 13.81 Favored 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 114.552 1.315 . . . . 1.2 114.552 -165.716 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.654 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 27.5 tt0 -43.85 -51.8 16.38 Favored Pre-proline 0 N--CA 1.47 0.539 0 N-CA-C 112.797 0.666 . . . . 0.75 112.797 -173.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.582 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 47.6 Cg_exo -55.08 -46.06 36.01 Favored 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 121.901 1.734 . . . . 0.56000000000000005 111.824 176.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . 0.594 ' CD1' HG13 ' A' ' 95' ' ' VAL . 0.1 OUTLIER -61.39 -41.02 96.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.581 -0.736 . . . . 1.2 110.802 179.07 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.475 HD12 ' HA ' ' A' ' 139' ' ' GLU . 3.5 mt -54.55 -47.64 71.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.103 0.478 . . . . 0.32000000000000001 110.628 174.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.654 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 67.0 mm-40 -58.24 -34.19 70.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.415 -0.811 . . . . 0.56999999999999995 110.916 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 5.4 mm-40 -65.19 -23.17 67.02 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 121.46 0.647 . . . . 0.78000000000000003 110.892 178.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.627 HD22 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -102.12 2.74 37.8 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.164 -0.926 . . . . 0.93000000000000005 109.315 -174.656 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.6 -44.14 1.53 Allowed Glycine 0 N--CA 1.439 -1.1 0 CA-C-N 114.813 -1.085 . . . . 0.56000000000000005 112.436 177.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 138.66 175.78 14.18 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.728 -0.749 . . . . 0.48999999999999999 111.911 -178.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.416 ' HZ3' ' O ' ' A' ' 1' ' ' MET . 5.5 m-90 -68.27 -43.93 76.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.776 0.322 . . . . 3.5699999999999998 110.697 -179.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.419 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 23.4 t70 -63.11 -39.65 95.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.115 -0.493 . . . . 1.96 109.908 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.548 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 94.1 m -56.25 -36.67 68.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.605 -0.725 . . . . 0.67000000000000004 111.069 177.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.691 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 75.1 t80 -59.98 -42.97 95.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.837 0.351 . . . . 3.0 110.277 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.673 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.1 m -73.4 -24.75 20.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.408 0.623 . . . . 1.1499999999999999 110.05 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 8.2 mm-40 -64.49 -23.63 67.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.016 0.436 . . . . 1.6699999999999999 109.908 173.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 150' ' ' THR . 1.9 mt -98.52 -53.46 3.32 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.964 -0.562 . . . . 1.3 110.768 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -120.79 26.44 9.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.684 -0.689 . . . . 4.2400000000000002 111.436 -170.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.762 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -57.83 160.2 11.92 Favored Glycine 0 N--CA 1.448 -0.527 0 CA-C-N 116.102 -0.499 . . . . 1.1000000000000001 113.638 -177.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.647 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 28.7 t-20 -46.44 123.64 5.06 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 113.691 -1.254 . . . . 1.29 112.317 -177.072 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.7 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 4.8 m120 -71.81 -27.46 62.94 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 112.533 0.568 . . . . 2.9900000000000002 112.533 -173.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -61.39 -40.55 94.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.176 0.513 . . . . 2.52 109.856 175.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.483 ' O ' ' HD3' ' A' ' 164' ' ' ARG . . . -74.13 -36.78 64.2 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.714 -0.675 . . . . 2.8700000000000001 109.991 174.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.552 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -58.17 -61.79 2.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.94 -0.573 . . . . 3.2000000000000002 111.382 179.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.7 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 8.0 pt-20 -55.68 -32.03 62.91 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 111.65 0.241 . . . . 3.7200000000000002 111.65 176.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 42.5 t -66.73 -45.5 78.47 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.028 0.442 . . . . 4.1799999999999997 110.285 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . 0.483 ' HD3' ' O ' ' A' ' 160' ' ' ALA . 10.0 mpt_? -75.3 -15.2 60.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.354 0.597 . . . . 5.8200000000000003 110.319 178.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 30.6 ttpt -78.45 -54.22 6.4 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.909 -1.041 . . . . 4.7699999999999996 110.116 174.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -65.9 -26.89 72.37 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 115.272 -0.876 . . . . 5.0999999999999996 113.504 -173.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.43 ' OE1' ' HA ' ' A' ' 164' ' ' ARG . 17.6 pt20 -67.33 -16.67 64.39 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.49 -0.418 . . . . 5.7199999999999998 110.997 179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -82.24 -1.9 50.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.016 0.436 . . . . 5.8799999999999999 110.295 176.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.505 ' O ' ' HD2' ' A' ' 169' ' ' ARG . 5.7 tmm_? -84.33 -33.29 23.93 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.04 -1.096 . . . . 7.3399999999999999 108.04 173.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -77.79 -48.48 16.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.118 -0.946 . . . . 6.9699999999999998 109.034 175.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 57.91 91.52 0.04 OUTLIER 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.039 -0.982 . . . . 6.9699999999999998 111.434 175.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 45.7 m80 -81.71 -11.38 59.07 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.837 -0.62 . . . . 9.3499999999999996 110.167 178.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -164.58 140.35 5.86 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.4 -0.963 . . . . 11.4 108.4 174.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 36.3 m80 -58.02 -53.95 52.43 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.384 0.427 . . . . 11.52 111.742 -174.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -90.89 170.86 9.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.765 0.316 . . . . 14.48 111.293 -177.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -54.37 143.67 22.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.668 -0.696 . . . . 15.369999999999999 110.922 178.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 9.4 p-80 -144.65 -175.97 4.87 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.87 -0.605 . . . . 16.02 110.27 -177.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.411 ' N ' HD12 ' A' ' 178' ' ' LEU . 6.4 mp -65.83 -48.13 72.72 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 123.177 0.298 . . . . 17.989999999999998 111.696 -171.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 61.38 20.81 11.45 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.247 0.342 . . . . 19.190000000000001 111.554 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 56.98 37.49 28.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 22.260000000000002 110.747 -176.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 -68.34 -24.69 64.84 Favored 'General case' 0 C--N 1.334 -0.08 0 CA-C-N 115.844 -0.616 . . . . 22.510000000000002 109.618 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 29.3 m80 -102.08 96.04 6.74 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.093 -0.706 . . . . 24.890000000000001 109.093 171.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -75.06 -35.15 61.87 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.07 -0.514 . . . . 25.579999999999998 110.492 -177.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 21.9 p-80 -117.26 148.34 41.75 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 110.013 -0.366 . . . . 27.370000000000001 110.013 178.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 35.8 t-80 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.369 -0.824 . . . . 29.059999999999999 110.245 -177.957 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.312 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -97.14 -44.58 2.77 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.809 -0.71 . . . . 2.9700000000000002 111.949 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.5 ' HA ' ' C2 ' ' B' 1100 ' ' 33B . 31.6 m -113.55 -147.73 0.42 Allowed 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.704 -0.48 . . . . 1.9399999999999999 109.704 178.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.974 HG23 ' H ' ' B' 1005 ' ' GLY . 17.6 m 53.07 -100.28 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 O-C-N 123.933 0.77 . . . . 1.6299999999999999 112.165 169.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 0.974 ' H ' HG23 ' B' 1004 ' ' VAL . . . -46.21 -19.88 0.46 Allowed Glycine 0 CA--C 1.534 1.252 0 CA-C-N 118.968 0.804 . . . . 1.2 114.512 167.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . 0.453 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 6.6 mpt_? -98.87 -27.21 14.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 117.537 0.668 . . . . 2.8799999999999999 112.171 173.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . 0.488 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -91.96 -65.44 1.01 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.235 0.457 . . . . 1.3100000000000001 112.235 -169.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.603 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 18.2 mt -66.5 -35.91 81.44 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 108.946 -0.761 . . . . 1.3300000000000001 108.946 -176.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 0.747 ' HA ' HH12 ' A' ' 99' ' ' ARG . . . -42.25 -58.62 2.1 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.681 -1.145 . . . . 0.88 111.351 165.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.785 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -72.07 -40.21 68.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.136 -0.938 . . . . 1.03 111.789 -175.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.538 ' HE2' ' H8 ' ' B' 1100 ' ' 33B . 36.9 m-85 -67.65 -24.49 65.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.111 0.481 . . . . 1.6699999999999999 110.397 177.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . 0.565 ' O ' HG13 ' B' 1015 ' ' ILE . . . -79.64 -5.1 89.46 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.681 -0.69 . . . . 0.78000000000000003 112.456 178.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 20.8 t70 -74.85 -22.0 58.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.428 0.632 . . . . 1.8999999999999999 109.685 175.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 28.3 m -80.12 8.43 7.22 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.571 -0.74 . . . . 1.4399999999999999 112.33 -173.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.565 HG13 ' O ' ' B' 1012 ' ' GLY . 2.7 pp -87.79 4.5 4.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.572 -0.451 . . . . 2.9100000000000001 110.836 175.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -100.7 154.04 18.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.894 -0.594 . . . . 4.29 109.818 178.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -105.21 -79.88 0.55 Allowed 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.818 0.342 . . . . 8.1699999999999999 110.166 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 116.65 -0.25 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.785 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.47 ' HA ' ' OE1' ' A' ' 42' ' ' GLU . 26.5 ptt? . . . . . 0 N--CA 1.478 0.94 0 CA-C-O 120.569 0.223 . . . . 6.21 110.869 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.3 p -72.12 -57.2 4.46 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.717 0.265 . . . . 1.8700000000000001 111.717 -174.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.709 ' HG3' ' HB3' ' A' ' 36' ' ' GLU . 37.8 tp60 -73.22 0.93 10.4 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.83 0.348 . . . . 2.4199999999999999 111.619 -174.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.417 ' OG ' ' HB3' ' A' ' 43' ' ' SER . 11.7 t -70.63 -15.2 62.71 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.068 0.461 . . . . 1.25 110.563 176.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.818 ' HA ' HD22 ' A' ' 8' ' ' LEU . 7.2 p30 -56.88 -20.83 25.3 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.269 -0.423 . . . . 1.78 111.226 176.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.571 ' HG2' ' HG3' ' A' ' 36' ' ' GLU . 6.8 tpp180 -59.49 -56.2 25.03 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.971 -0.559 . . . . 1.3999999999999999 110.393 174.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.425 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 42.5 mt-10 -57.01 -48.1 79.29 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 115.117 -0.947 . . . . 0.68000000000000005 110.968 -178.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.818 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.1 OUTLIER -49.17 -31.64 8.76 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 114.933 -1.031 . . . . 1.1599999999999999 111.592 178.75 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.535 HG21 ' N ' ' A' ' 131' ' ' ALA . 78.3 t -81.04 -63.01 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-O 121.555 0.693 . . . . 0.27000000000000002 109.897 172.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 6' ' ' ARG . 55.2 t -54.18 -46.93 67.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.565 -1.198 . . . . 0.33000000000000002 113.066 -171.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -56.17 -38.99 71.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.66 0.267 . . . . 0.58999999999999997 110.979 -177.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.714 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 14.7 t80 -71.96 -42.19 66.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.302 -0.408 . . . . 1.6100000000000001 110.217 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 1.025 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.5 mp -60.53 -41.18 93.92 Favored 'General case' 0 C--O 1.231 0.101 0 C-N-CA 120.499 -0.48 . . . . 0.34000000000000002 109.952 176.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.496 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 23.0 t -61.2 -47.39 86.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 1.05 110.489 178.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -62.4 -30.95 71.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.78 -0.646 . . . . 1.22 110.738 177.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.711 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.4 OUTLIER -81.24 -33.83 32.55 Favored 'General case' 0 N--CA 1.432 -1.347 0 CA-C-N 116.109 -0.496 . . . . 1.4099999999999999 112.276 -173.815 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.586 ' O ' ' HD3' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -62.23 -27.73 69.2 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.371 0.605 . . . . 1.3500000000000001 110.024 174.509 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.4 t -71.39 -16.25 62.4 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.627 -0.715 . . . . 0.93999999999999995 111.56 -176.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.711 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 19.7 pt20 -79.19 -12.76 59.97 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.356 0.598 . . . . 1.3700000000000001 111.506 -176.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.777 ' NZ ' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -115.51 -20.05 10.37 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 122.197 0.999 . . . . 2.2000000000000002 109.412 179.415 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.28 28.97 5.59 Favored Glycine 0 C--N 1.306 -1.101 0 CA-C-N 113.696 -1.593 . . . . 0.53000000000000003 112.931 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -112.77 168.41 9.7 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.724 0.297 . . . . 0.76000000000000001 111.06 169.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.491 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 5.6 t -110.57 152.31 26.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.341 -0.391 . . . . 0.52000000000000002 110.743 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.496 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.5 OUTLIER -75.19 -46.7 32.4 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.972 -0.558 . . . . 3.3599999999999999 110.279 173.094 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.428 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 13.2 p -65.85 -25.34 67.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.358 -0.383 . . . . 1.3700000000000001 111.5 -173.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.491 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 97.3 mt-30 -63.43 -30.29 71.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.931 0.396 . . . . 1.1100000000000001 111.051 176.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -121.85 18.51 11.01 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.052 -0.522 . . . . 1.28 111.777 -173.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.428 ' OG ' ' HA ' ' A' ' 25' ' ' SER . 93.3 p -101.02 -178.68 3.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.912 0.863 . . . . 1.8100000000000001 113.156 -171.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.496 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.3 t70 -165.34 -25.52 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.586 -1.643 . . . . 2.3100000000000001 108.43 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.899 HG23 ' H ' ' A' ' 31' ' ' GLU . 15.2 m -55.29 -72.12 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 114.1 -1.409 . . . . 0.92000000000000004 113.014 -174.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.899 ' H ' HG23 ' A' ' 30' ' ' VAL . 34.8 mt-10 -90.17 0.03 57.38 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.759 0.79 . . . . 2.7400000000000002 108.873 177.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 30.8 tt0 -75.29 -52.13 11.58 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.53 -1.214 . . . . 1.45 110.453 -178.181 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -102.56 -38.72 7.41 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.672 -0.695 . . . . 1.8700000000000001 110.298 -178.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 11.6 mtp180 -93.42 157.98 15.95 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.199 0.524 . . . . 3.3900000000000001 111.516 177.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.1 p -138.04 94.36 2.87 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.069 -0.969 . . . . 2.25 110.007 172.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.709 ' HB3' ' HG3' ' A' ' 3' ' ' GLN . 4.2 mm-40 -60.61 -90.8 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.072 -1.422 . . . . 3.3399999999999999 111.26 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.675 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -101.22 178.07 1.34 Allowed Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 108.709 -0.849 . . . . 1.9199999999999999 108.709 177.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.675 ' HD2' ' HB1' ' A' ' 37' ' ' ALA . 34.1 Cg_exo -52.12 151.88 15.83 Favored 'Trans proline' 0 N--CA 1.46 -0.485 0 C-N-CA 121.948 1.766 . . . . 1.8700000000000001 110.533 171.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -74.13 16.29 0.25 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.267 0.556 . . . . 4.6399999999999997 111.861 -173.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.412 ' H ' ' C ' ' A' ' 38' ' ' PRO . . . 163.4 61.5 0.02 OUTLIER Glycine 0 N--CA 1.437 -1.274 0 CA-C-N 115.766 -0.652 . . . . 2.1499999999999999 111.733 176.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.737 HG23 ' OE2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -81.55 -73.73 0.37 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 120.296 -0.561 . . . . 1.1200000000000001 110.147 179.794 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.737 ' OE2' HG23 ' A' ' 41' ' ' THR . 0.0 OUTLIER -94.18 -32.85 13.54 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.806 0.812 . . . . 2.02 109.814 170.222 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.801 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 5.4 p -56.63 -36.29 69.3 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 113.94 -1.482 . . . . 1.25 113.613 -171.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -46.14 -43.65 15.14 Favored 'General case' 0 C--N 1.32 -0.693 0 O-C-N 123.311 0.382 . . . . 1.9099999999999999 111.894 -173.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.431 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -83.42 -36.86 23.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.777 0.322 . . . . 0.52000000000000002 110.482 176.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.682 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 79.0 t -54.91 -66.58 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 CA-C-N 115.753 -0.658 . . . . 1.4099999999999999 111.174 177.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.801 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.8 ptpt -58.26 -37.99 76.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.783 -0.644 . . . . 0.67000000000000004 110.353 -177.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.73 HE21 ' ND2' ' A' ' 157' ' ' ASN . 7.2 mm100 -63.84 -26.38 68.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.645 -0.707 . . . . 0.98999999999999999 111.402 175.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.57 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -84.97 -32.03 23.22 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.437 0.637 . . . . 0.41999999999999998 109.819 177.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 46' ' ' VAL . 9.8 mt -67.91 -21.46 65.12 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.054 -0.976 . . . . 1.3300000000000001 111.216 -175.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.592 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 13.0 ptp180 -89.73 -35.31 15.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.574 0.702 . . . . 2.1699999999999999 109.485 -178.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.743 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.0 mm-40 -67.65 -46.13 73.32 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.789 -1.096 . . . . 1.1000000000000001 109.396 175.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -71.44 -33.19 69.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.416 -0.811 . . . . 0.53000000000000003 110.325 176.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.644 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -63.26 -43.63 98.21 Favored Glycine 0 CA--C 1.507 -0.463 0 CA-C-N 115.896 -0.593 . . . . 0.69999999999999996 111.759 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.58 ' O ' HD22 ' A' ' 59' ' ' LEU . 28.5 t70 -56.54 -34.74 67.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.873 0.368 . . . . 1.04 110.735 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -68.28 -26.85 65.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.288 -0.869 . . . . 2.29 111.72 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -83.25 -39.19 21.2 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.117 -0.492 . . . . 2.29 111.352 176.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.763 ' HA ' ' CE2' ' A' ' 61' ' ' TYR . 43.6 mt-10 -66.97 -53.39 32.08 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 112.892 0.701 . . . . 1.3 112.892 -166.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.58 HD22 ' O ' ' A' ' 55' ' ' ASP . 2.3 pt? -51.31 -35.04 35.99 Favored 'General case' 0 C--N 1.32 -0.676 0 O-C-N 123.787 0.68 . . . . 1.54 111.021 -172.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 79.8 mtt-85 -64.82 -52.35 57.23 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.213 -0.903 . . . . 2.5800000000000001 111.621 -178.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.763 ' CE2' ' HA ' ' A' ' 58' ' ' GLU . 16.4 p90 -91.62 -14.43 30.2 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.082 0.401 . . . . 5.3200000000000003 112.082 -174.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -60.06 -17.29 38.32 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.029 0.381 . . . . 4.4800000000000004 112.029 -170.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 47.7 ttp180 -61.54 -36.64 81.14 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.016 0.436 . . . . 4.7199999999999998 110.72 177.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.619 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -91.43 -24.1 19.82 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.018 0.377 . . . . 1.1699999999999999 112.018 -179.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.535 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 55.0 t80 -40.99 -52.97 3.07 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.621 0.971 . . . . 2.8100000000000001 113.621 -171.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.0 t -69.09 -23.4 64.0 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.904 0.383 . . . . 2.1899999999999999 111.25 -172.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -89.97 -28.56 19.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.307 -0.406 . . . . 2.7200000000000002 111.14 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 48.6 mt -70.69 -18.49 62.82 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 112.455 0.539 . . . . 1.5600000000000001 112.455 -173.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.499 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 2.1 p -55.21 -37.21 66.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.095 0.474 . . . . 0.69999999999999996 111.189 -178.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 28.2 t -61.42 -35.47 77.64 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.599 -0.728 . . . . 1.3400000000000001 109.983 175.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -80.6 -35.44 34.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.336 -0.847 . . . . 1.4199999999999999 110.616 -177.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.521 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.4 mm? -65.61 -33.12 75.17 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.784 -0.45 . . . . 1.3700000000000001 109.784 172.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.477 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 57.6 m-70 67.81 42.63 1.91 Allowed 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 108.254 -1.017 . . . . 2.7200000000000002 108.254 -172.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.521 HG12 ' HB2' ' A' ' 72' ' ' LEU . 28.4 mm -53.32 114.95 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 114.039 -1.437 . . . . 0.91000000000000003 111.114 179.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.783 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.76 -168.72 0.21 Allowed Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 107.369 -1.345 . . . . 0.51000000000000001 107.369 -171.504 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.783 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 71.6 Cg_exo -28.96 165.79 0.0 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.507 3.471 . . . . 0.46999999999999997 115.183 163.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.61 -26.54 0.0 OUTLIER Glycine 0 N--CA 1.475 1.291 0 N-CA-C 118.258 2.063 . . . . 0.40000000000000002 118.258 -171.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.47 ' N ' ' O ' ' A' ' 76' ' ' PRO . 45.4 p -69.29 6.49 0.99 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.493 1.146 . . . . 0.56000000000000005 112.125 -179.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.406 ' HA ' ' OG ' ' A' ' 82' ' ' SER . . . -71.93 -12.48 61.27 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.286 0.565 . . . . 0.34000000000000002 110.237 173.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -77.52 -19.75 55.3 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.261 -0.644 . . . . 4.1299999999999999 109.261 175.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.467 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 30.3 mt-30 -84.39 -20.8 31.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.867 0.841 . . . . 1.03 109.687 173.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.406 ' OG ' ' HA ' ' A' ' 79' ' ' ALA . 3.0 m -74.42 -51.6 14.49 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 114.502 -1.226 . . . . 0.47999999999999998 109.094 170.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.424 ' HA ' HG23 ' A' ' 86' ' ' VAL . 66.6 t80 -66.27 -17.91 65.03 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.991 -1.004 . . . . 1.1799999999999999 110.149 175.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.525 ' HA ' HG12 ' A' ' 87' ' ' VAL . 32.1 tt0 -59.47 -51.31 70.4 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-O 121.624 0.726 . . . . 0.80000000000000004 109.869 178.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.481 ' HG2' ' H ' ' A' ' 85' ' ' GLN . 55.4 mm-40 -48.22 -32.64 7.42 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 113.456 -1.702 . . . . 1.6200000000000001 110.706 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.607 ' HA ' ' HG3' ' A' ' 89' ' ' GLU . 0.8 OUTLIER -89.06 -51.36 12.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 113.961 -1.472 . . . . 1.3 111.25 -175.413 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.525 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.9 p -60.96 -22.17 26.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-O 121.824 0.821 . . . . 0.84999999999999998 109.372 -177.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.456 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 5.1 m-80 -77.45 -36.91 52.52 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 113.982 -1.463 . . . . 0.91000000000000003 111.858 175.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.973 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.0 OUTLIER -83.91 -17.34 41.08 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 121.951 0.882 . . . . 2.8700000000000001 110.284 179.88 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.686 ' HG ' HH11 ' A' ' 99' ' ' ARG . 0.0 OUTLIER -75.43 -50.74 14.9 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 114.98 -1.009 . . . . 1.28 110.525 -179.483 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.456 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 4.4 p90 -88.36 -23.71 23.31 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.204 0.816 . . . . 2.2999999999999998 113.204 -166.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.685 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -58.19 -39.55 79.24 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.454 0.909 . . . . 5.0599999999999996 113.454 -165.23 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -110.08 22.94 14.97 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 115.113 1.523 . . . . 3.1200000000000001 115.113 -167.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 134.41 73.63 0.08 OUTLIER Glycine 0 C--N 1.318 -0.462 0 C-N-CA 117.457 -2.306 . . . . 2.3100000000000001 115.303 -176.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.641 HG22 HH21 ' A' ' 99' ' ' ARG . 89.0 t -71.72 102.69 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.79 0.805 . . . . 1.0600000000000001 111.56 178.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -112.01 -174.87 2.55 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.784 -1.098 . . . . 2.1200000000000001 109.531 -179.021 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.605 ' HB3' ' CD1' ' A' ' 151' ' ' PHE . 18.7 m-90 -59.8 -60.64 3.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.111 0.481 . . . . 3.3399999999999999 110.643 178.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.553 ' O ' ' HB ' ' A' ' 101' ' ' VAL . . . -66.66 -25.84 72.9 Favored Glycine 0 C--N 1.33 0.211 0 CA-C-N 115.647 -0.706 . . . . 0.68999999999999995 112.544 -176.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.686 HH11 ' HG ' ' A' ' 90' ' ' LEU . 1.1 tmm_? -64.67 -39.87 94.43 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.475 -0.565 . . . . 4.2400000000000002 109.475 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.606 HG22 ' CE2' ' A' ' 104' ' ' PHE . 82.9 mt -69.86 -33.14 54.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.266 -0.425 . . . . 0.44 110.406 178.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.553 ' HB ' ' O ' ' A' ' 98' ' ' GLY . 91.6 t -51.46 -57.14 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-N 116.002 -0.545 . . . . 1.3500000000000001 110.44 170.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -47.76 -41.84 24.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.012 -0.994 . . . . 0.44 111.52 178.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.468 ' HB3' ' O ' ' A' ' 100' ' ' ILE . 27.5 t80 -60.29 -43.1 96.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.999 -1.001 . . . . 1.49 110.934 178.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.606 ' CE2' HG22 ' A' ' 100' ' ' ILE . 37.4 m-85 -68.41 -37.64 80.5 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.325 . . . . 3.29 110.565 175.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.714 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 16.2 m -61.82 -54.88 36.17 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.861 -0.609 . . . . 1.1899999999999999 111.071 -176.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -72.56 -31.04 64.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.823 0.344 . . . . 2.8900000000000001 110.281 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.655 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -66.79 -43.73 90.98 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.87 -0.681 . . . . 0.29999999999999999 111.81 177.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 1.025 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.85 -29.02 73.39 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.686 -0.769 . . . . 0.23000000000000001 111.189 175.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.535 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -72.7 -34.14 66.93 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.402 -0.399 . . . . 0.31 110.244 177.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.523 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.3 OUTLIER -65.57 -34.64 78.72 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.933 0.873 . . . . 1.1200000000000001 109.996 -179.072 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.68 ' O ' HG23 ' A' ' 115' ' ' VAL . 43.0 t -51.89 -50.04 61.83 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 114.268 -1.333 . . . . 0.26000000000000001 109.369 171.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.777 HG13 ' NZ ' ' A' ' 20' ' ' LYS . 97.1 t -64.9 -36.24 77.22 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 116.268 -0.424 . . . . 0.34999999999999998 110.527 176.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.523 ' OE2' ' HA ' ' A' ' 110' ' ' LEU . 37.5 mt-10 -54.65 -37.63 65.93 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.073 0.463 . . . . 2.5099999999999998 110.341 175.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 21.1 m -78.85 -38.79 37.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.983 -0.553 . . . . 0.28000000000000003 109.995 -178.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.68 HG23 ' O ' ' A' ' 111' ' ' CYS . 93.6 t -68.53 -33.26 59.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.716 0.77 . . . . 1.23 109.197 -177.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -55.67 -50.13 71.08 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 113.757 -1.565 . . . . 0.59999999999999998 111.575 -178.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 29.0 mmtt -87.5 13.48 10.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.932 -0.576 . . . . 1.6200000000000001 110.211 -178.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.649 ' HA ' HE21 ' A' ' 120' ' ' GLN . 20.9 mm-40 63.88 52.02 2.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.821 0.819 . . . . 1.8799999999999999 111.502 -178.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.59 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 25.9 mtm -130.64 48.37 2.42 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 107.751 -1.203 . . . . 0.31 107.751 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.649 HE21 ' HA ' ' A' ' 118' ' ' GLU . 4.7 mp0 -64.17 -8.26 11.75 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 114.756 -1.111 . . . . 1.1499999999999999 112.4 -173.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.581 HG23 HD22 ' A' ' 122' ' ' LEU . 28.2 m -64.62 -19.66 25.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.808 0.337 . . . . 0.46000000000000002 111.575 176.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.617 HD13 ' HD3' ' A' ' 125' ' ' ARG . 3.1 mm? -79.81 -24.29 41.5 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.468 -0.333 . . . . 0.26000000000000001 110.146 178.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.662 HG13 ' SG ' ' A' ' 111' ' ' CYS . 56.7 t -46.93 -56.72 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 O-C-N 123.658 0.599 . . . . 0.25 111.849 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.415 ' OG ' HG13 ' A' ' 30' ' ' VAL . 6.6 t -71.1 -29.84 65.79 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.712 -0.395 . . . . 1.3500000000000001 110.275 -178.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.617 ' HD3' HD13 ' A' ' 122' ' ' LEU . 17.2 mtp180 -65.1 -58.51 5.85 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 116.283 -0.417 . . . . 2.6699999999999999 110.857 178.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 122' ' ' LEU . 79.2 mt -49.93 -49.9 20.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.58 -0.737 . . . . 0.23000000000000001 110.565 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.666 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -59.04 -36.49 75.11 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.727 0.299 . . . . 0.28999999999999998 111.528 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -65.26 -56.69 11.29 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.504 0.668 . . . . 0.28000000000000003 110.936 177.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.486 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 94.3 m95 -64.47 -35.0 79.53 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.809 -1.087 . . . . 3.9100000000000001 111.182 -176.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.655 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 1.2 mmm -63.87 -50.5 68.58 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 121.073 0.463 . . . . 1.0800000000000001 110.824 177.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.535 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -63.48 -34.81 78.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.859 -0.61 . . . . 0.25 110.472 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 69.4 m -64.46 -48.12 76.46 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.165 -0.47 . . . . 0.40000000000000002 110.955 177.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -56.95 -39.56 74.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.814 0.34 . . . . 3.1299999999999999 110.094 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.624 HD13 ' HB2' ' A' ' 5' ' ' ASN . 5.6 tt -60.93 -52.08 66.55 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.702 -0.851 . . . . 0.94999999999999996 108.702 173.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -50.58 -49.09 57.2 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.742 -0.663 . . . . 0.46000000000000002 112.023 179.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.96 -53.43 6.75 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.028 0.442 . . . . 0.58999999999999997 111.485 -174.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.7 -51.07 5.42 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 112.953 0.723 . . . . 1.45 112.953 -169.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 40.6 mt -86.68 -31.57 20.97 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.908 0.707 . . . . 1.2 112.908 -163.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 31.1 tt0 -51.76 -51.95 65.48 Favored Pre-proline 0 C--N 1.322 -0.602 0 N-CA-C 112.247 0.462 . . . . 0.75 112.247 -173.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.583 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 32.9 Cg_exo -59.48 -46.68 19.79 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 121.621 1.547 . . . . 0.56000000000000005 111.643 176.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . 0.52 ' CE2' ' HB ' ' A' ' 95' ' ' VAL . 0.5 OUTLIER -53.32 -53.32 52.7 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.658 -0.701 . . . . 1.2 110.31 177.787 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.554 HG22 ' HA2' ' A' ' 147' ' ' GLY . 45.5 mt -47.09 -52.79 4.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.446 -0.797 . . . . 0.32000000000000001 111.662 174.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.626 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.3 mm-40 -59.83 -32.01 70.27 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.129 -0.487 . . . . 0.56999999999999995 111.678 -178.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 13.4 mm-40 -64.5 -21.29 66.63 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.482 0.658 . . . . 0.78000000000000003 110.767 177.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -112.68 6.37 18.2 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.212 -0.904 . . . . 0.93000000000000005 110.786 -173.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 118.05 -46.69 1.11 Allowed Glycine 0 N--CA 1.442 -0.928 0 CA-C-N 115.501 -0.772 . . . . 0.56000000000000005 113.099 173.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.554 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 132.74 -171.68 21.58 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.322 -0.942 . . . . 0.48999999999999999 112.476 -178.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.446 ' NE1' HD13 ' A' ' 142' ' ' ILE . 19.7 m-90 -80.02 -45.92 17.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.96 0.409 . . . . 3.5699999999999998 110.427 -178.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.444 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 18.9 t70 -56.86 -37.88 71.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.412 -0.813 . . . . 1.96 110.018 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.653 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 90.6 m -59.37 -36.65 76.15 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.346 -0.843 . . . . 0.67000000000000004 111.384 178.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.605 ' CD1' ' HB3' ' A' ' 97' ' ' TRP . 62.6 t80 -63.63 -35.74 81.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.921 0.391 . . . . 3.0 110.493 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.603 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 0.7 OUTLIER -74.51 -25.3 19.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-O 121.463 0.649 . . . . 1.1499999999999999 109.67 178.197 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 7.0 mm-40 -70.1 -26.54 64.03 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.736 -0.665 . . . . 1.6699999999999999 109.383 173.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.653 ' HG ' ' O ' ' A' ' 150' ' ' THR . 12.1 mt -83.24 -58.63 2.76 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 115.545 -0.752 . . . . 1.3 110.338 177.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 41.9 t80 -114.51 -42.34 3.31 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.597 -0.274 . . . . 4.2400000000000002 110.495 -175.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.57 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . 47.54 -156.01 0.94 Allowed Glycine 0 CA--C 1.506 -0.474 0 O-C-N 123.89 0.744 . . . . 1.1000000000000001 114.037 -177.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.743 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 26.3 t-20 -104.41 109.02 20.72 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 114.844 -0.678 . . . . 1.29 110.113 -176.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.734 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 19.6 m120 -72.53 -22.41 61.03 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.534 -0.303 . . . . 2.9900000000000002 111.717 -172.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -56.52 -43.57 79.94 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.005 0.431 . . . . 2.52 110.135 173.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' A' ' 163' ' ' SER . . . -89.97 -40.0 12.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.133 -0.485 . . . . 2.8700000000000001 111.062 177.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.734 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -57.36 -54.09 50.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.194 -0.457 . . . . 3.2000000000000002 111.778 -177.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -66.4 -18.56 65.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.713 0.292 . . . . 3.7200000000000002 111.342 -178.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.464 ' HB3' ' O ' ' A' ' 160' ' ' ALA . 47.7 t -68.67 -30.41 69.08 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.626 -0.509 . . . . 4.1799999999999997 109.626 174.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . 0.521 ' O ' ' HG3' ' A' ' 168' ' ' GLU . 12.2 mpt_? -88.14 -25.21 23.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.26 0.552 . . . . 5.8200000000000003 109.871 176.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -61.95 -36.35 81.16 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.423 -0.808 . . . . 4.7699999999999996 110.127 177.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -63.73 -33.46 87.29 Favored Glycine 0 N--CA 1.448 -0.511 0 CA-C-N 115.643 -0.708 . . . . 5.0999999999999996 112.921 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -89.15 -19.45 25.48 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.862 0.331 . . . . 5.7199999999999998 111.162 -179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.521 ' HG3' ' O ' ' A' ' 164' ' ' ARG . 41.4 mt-10 -82.6 7.83 13.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.689 0.28 . . . . 5.8799999999999999 110.581 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.515 ' HG3' HD22 ' A' ' 170' ' ' LEU . 21.5 tpp180 -49.91 -52.84 30.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.817 -0.629 . . . . 7.3399999999999999 110.787 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.515 HD22 ' HG3' ' A' ' 169' ' ' ARG . 3.6 mm? -121.86 -27.36 4.66 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.16 -0.473 . . . . 6.9699999999999998 110.325 177.205 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -77.59 87.66 3.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.242 0.544 . . . . 6.9699999999999998 110.305 178.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -164.81 165.55 20.49 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.588 -0.733 . . . . 9.3499999999999996 109.321 178.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 71.0 t60 -73.05 127.39 32.43 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.913 0.387 . . . . 11.4 110.421 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 32.7 p80 -128.44 170.08 13.55 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.065 -0.716 . . . . 11.52 109.065 173.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 78.6 m-70 -78.24 142.52 37.8 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.887 0.375 . . . . 14.48 110.253 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -130.51 145.93 51.95 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.638 -0.875 . . . . 15.369999999999999 108.638 177.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 43.5 t-80 67.7 86.14 0.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.473 0.654 . . . . 16.02 109.418 -174.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -168.92 149.65 4.43 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.06 -0.973 . . . . 17.989999999999998 108.823 -176.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -75.02 113.76 12.71 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.237 0.541 . . . . 19.190000000000001 109.892 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -136.36 101.81 4.78 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.568 -0.742 . . . . 22.260000000000002 109.281 178.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -71.58 -37.45 71.03 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.649 -0.705 . . . . 22.510000000000002 111.68 -172.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 48.6 t-80 75.09 -37.2 0.34 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.4 0.68 . . . . 24.890000000000001 111.247 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -145.76 134.84 22.71 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.426 -0.583 . . . . 25.579999999999998 109.426 177.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 58.9 m80 -70.53 -45.26 65.88 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.803 0.335 . . . . 27.370000000000001 110.886 -178.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 9.8 p80 . . . . . 0 C--O 1.244 0.799 0 CA-C-O 118.908 -0.568 . . . . 29.059999999999999 110.416 178.679 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.074 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -94.39 69.12 1.3 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.617 -0.801 . . . . 2.9700000000000002 111.638 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.582 ' HA ' ' C2 ' ' B' 1100 ' ' 33B . 3.7 m -107.16 -156.42 0.58 Allowed 'General case' 0 C--N 1.324 -0.542 0 O-C-N 122.545 -0.385 . . . . 1.9399999999999999 110.667 -175.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.711 ' HA ' ' CD2' ' B' 1008 ' ' LEU . 4.9 m 38.94 -98.06 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 124.605 1.191 . . . . 1.6299999999999999 112.873 176.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 0.425 ' H ' HG23 ' B' 1004 ' ' VAL . . . -18.37 -45.47 0.01 OUTLIER Glycine 0 CA--C 1.537 1.464 0 N-CA-C 114.63 0.612 . . . . 1.2 114.63 159.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . 0.418 ' HA ' ' HD3' ' B' 1006 ' ' ARG . 31.8 mmt180 -105.71 -26.92 11.6 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 113.371 0.878 . . . . 2.8799999999999999 113.371 178.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -78.68 -61.36 2.04 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 113.282 0.845 . . . . 1.3100000000000001 113.282 -165.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.738 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 1.3 mm? -65.31 -44.65 87.2 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.734 -0.839 . . . . 1.3300000000000001 108.734 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 0.973 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -37.25 -52.03 1.05 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.512 -1.222 . . . . 0.88 110.855 169.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.773 ' HB1' ' N11' ' B' 1100 ' ' 33B . . . -76.75 -46.63 24.51 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 113.807 -1.542 . . . . 1.03 111.918 -174.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.587 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 30.3 m-85 -68.67 -24.91 64.58 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.36 -0.382 . . . . 1.6699999999999999 111.042 -178.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -72.72 -14.24 78.07 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.966 -0.561 . . . . 0.78000000000000003 112.464 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 13.3 t70 -64.78 -20.26 66.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.345 0.593 . . . . 1.8999999999999999 110.455 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 15.5 m -94.44 35.74 1.19 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.831 -0.622 . . . . 1.4399999999999999 111.889 -177.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.412 HG12 ' H ' ' B' 1015 ' ' ILE . 5.0 pt -77.77 69.54 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.998 0.428 . . . . 2.9100000000000001 111.745 177.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 10.9 p30 -126.18 175.66 7.62 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 110.171 -0.307 . . . . 4.29 110.171 177.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 45.2 mtp180 -90.7 92.9 9.02 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.21 -0.45 . . . . 8.1699999999999999 110.098 178.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.533 0 CA-C-N 116.418 -0.356 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.773 ' N11' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.1 0 CA-C-O 120.948 0.404 . . . . 6.21 110.447 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.9 m -69.42 114.67 7.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.255 -0.429 . . . . 1.8700000000000001 110.883 -177.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 72.9 mm-40 -63.99 -19.96 65.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.088 0.47 . . . . 2.4199999999999999 110.468 175.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.1 p -63.4 -23.5 67.43 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.623 -0.717 . . . . 1.25 112.028 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.909 ' HA ' HD22 ' A' ' 8' ' ' LEU . 73.1 m-20 -62.62 -28.18 69.73 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.308 0.575 . . . . 1.78 109.806 176.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.517 ' O ' HG23 ' A' ' 10' ' ' VAL . 7.0 tpp180 -60.64 -48.6 81.05 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.226 -0.897 . . . . 1.3999999999999999 110.22 177.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -56.76 -51.45 68.86 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.392 -0.822 . . . . 0.68000000000000005 111.209 -178.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.909 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.0 OUTLIER -47.62 -42.68 24.76 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.536 -0.756 . . . . 1.1599999999999999 110.912 177.531 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.488 HG11 ' HA ' ' A' ' 127' ' ' ALA . 73.1 t -68.88 -63.7 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.46 -0.791 . . . . 0.27000000000000002 110.195 176.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 6' ' ' ARG . 97.7 t -49.31 -53.68 8.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.416 -0.811 . . . . 0.33000000000000002 112.979 -176.277 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -57.81 -34.09 69.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.007 0.432 . . . . 0.58999999999999997 110.598 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.753 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.7 t80 -75.79 -46.52 30.25 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.111 -0.495 . . . . 1.6100000000000001 110.671 -179.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 1.058 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.5 mp -59.87 -42.72 94.33 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 120.787 -0.365 . . . . 0.34000000000000002 110.311 178.375 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.413 ' HA ' HD12 ' A' ' 17' ' ' LEU . 37.8 t -60.34 -38.89 85.22 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.951 -0.568 . . . . 1.05 110.47 178.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -71.33 -18.07 62.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.751 -0.659 . . . . 1.22 110.75 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.734 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 10.1 mmpt? -84.86 -46.36 11.4 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 121.368 0.604 . . . . 1.4099999999999999 110.252 -179.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.757 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 14.6 mt -55.95 -26.92 50.11 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.125 -0.943 . . . . 1.3500000000000001 111.276 177.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.6 t -58.55 -35.11 71.81 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.175 -0.921 . . . . 0.93999999999999995 112.522 176.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.734 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 27.8 pt20 -80.43 -7.94 59.34 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.989 0.737 . . . . 1.3700000000000001 112.989 -170.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 1.018 ' HZ2' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -111.93 -20.14 12.12 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 122.164 0.983 . . . . 2.2000000000000002 109.238 178.545 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.09 28.1 6.29 Favored Glycine 0 C--N 1.306 -1.134 0 CA-C-N 113.652 -1.613 . . . . 0.53000000000000003 112.741 174.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.545 ' HD1' ' HE3' ' A' ' 20' ' ' LYS . 70.8 m-85 -110.17 166.25 11.11 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.716 0.293 . . . . 0.76000000000000001 110.83 172.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.514 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 4.0 t -110.62 154.98 23.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.341 -0.391 . . . . 0.52000000000000002 110.554 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.571 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 68.0 t-105 -72.64 -54.5 8.88 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.101 -0.5 . . . . 3.3599999999999999 110.252 174.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 18.4 t -62.38 -27.52 69.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.699 -0.682 . . . . 1.3700000000000001 111.776 -173.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.514 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 95.3 mt-30 -59.26 -26.6 65.06 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 111.898 0.333 . . . . 1.1100000000000001 111.898 178.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -119.94 -10.73 9.42 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.086 0.402 . . . . 1.28 112.086 -173.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.548 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 49.3 m -101.89 179.53 4.3 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 113.627 0.973 . . . . 1.8100000000000001 113.627 -169.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.437 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 0.8 OUTLIER -156.08 -14.26 0.1 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.376 -1.284 . . . . 2.3100000000000001 110.015 -179.015 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.905 HG23 ' H ' ' A' ' 31' ' ' GLU . 12.3 m -51.95 -71.56 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.479 -1.237 . . . . 0.92000000000000004 112.76 -169.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.905 ' H ' HG23 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -99.9 1.22 42.61 Favored 'General case' 0 N--CA 1.442 -0.825 0 CA-C-O 121.54 0.686 . . . . 2.7400000000000002 109.672 177.844 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.437 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 24.5 tt0 -67.36 -56.03 11.36 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.697 -1.138 . . . . 1.45 111.157 -178.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -98.33 -51.67 3.9 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.9 -0.591 . . . . 1.8700000000000001 111.518 -172.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 28.9 ptt-85 -92.77 160.99 14.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.002 0.43 . . . . 3.3900000000000001 111.223 -176.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 1.3 p -113.07 114.1 26.37 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.507 0.67 . . . . 2.25 111.252 179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -122.22 -66.67 1.01 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.161 -0.927 . . . . 3.3399999999999999 109.832 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -97.64 148.83 35.01 Favored Pre-proline 0 C--N 1.318 -0.776 0 CA-C-N 115.24 -0.891 . . . . 1.9199999999999999 110.474 176.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.731 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 35.2 Cg_exo -62.0 -176.83 0.23 Allowed 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 123.13 2.553 . . . . 1.8700000000000001 112.258 175.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -81.43 -4.76 56.75 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.483 0.658 . . . . 4.6399999999999997 110.449 177.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 154.5 69.63 0.01 OUTLIER Glycine 0 N--CA 1.441 -0.971 0 CA-C-N 115.338 -0.846 . . . . 2.1499999999999999 111.168 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.798 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.6 OUTLIER -69.61 -76.43 0.1 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 120.89 0.376 . . . . 1.1200000000000001 110.46 -176.63 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.798 ' H ' HG23 ' A' ' 41' ' ' THR . 15.4 pt-20 -93.53 -27.82 16.42 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-O 123.176 1.465 . . . . 2.02 107.908 166.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.503 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.1 OUTLIER -66.83 -20.92 66.03 Favored 'General case' 0 C--N 1.309 -1.163 0 CA-C-N 111.676 -2.511 . . . . 1.25 113.954 -167.577 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 35.5 tt0 -54.89 -59.84 4.18 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 120.933 -0.307 . . . . 1.9099999999999999 111.012 -179.201 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.465 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -64.58 -36.35 83.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.223 0.535 . . . . 0.52000000000000002 110.034 179.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.566 ' HA ' HG12 ' A' ' 152' ' ' VAL . 99.4 t -59.5 -60.74 2.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 114.917 -1.038 . . . . 1.4099999999999999 111.14 178.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.485 ' HB3' HD12 ' A' ' 8' ' ' LEU . 11.2 ptpt -62.42 -35.13 78.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.624 0.726 . . . . 0.67000000000000004 109.255 -176.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.669 ' NE2' ' HD3' ' A' ' 51' ' ' ARG . 7.1 mm100 -65.95 -32.31 73.73 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 114.941 -1.027 . . . . 0.98999999999999999 110.826 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.695 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -74.5 -43.88 53.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.13 0.49 . . . . 0.41999999999999998 110.624 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.474 ' O ' ' HE2' ' A' ' 12' ' ' PHE . 8.0 mp -63.25 -26.54 68.83 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.429 -0.805 . . . . 1.3300000000000001 112.88 -174.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.669 ' HD3' ' NE2' ' A' ' 48' ' ' GLN . 10.4 ptm180 -78.51 -32.41 48.09 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.156 -1.053 . . . . 2.1699999999999999 108.156 -175.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 3.7 mm-40 -80.41 -44.19 19.75 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 113.565 -1.652 . . . . 1.1000000000000001 109.907 -179.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.29 -41.08 98.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.486 -0.779 . . . . 0.53000000000000003 110.169 175.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.729 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.16 -42.23 98.49 Favored Glycine 0 C--O 1.22 -0.759 0 CA-C-N 115.558 -0.746 . . . . 0.69999999999999996 112.001 177.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.59 ' O ' HD22 ' A' ' 59' ' ' LEU . 29.8 t70 -53.46 -37.78 62.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.948 0.404 . . . . 1.04 111.296 179.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -71.93 -24.92 61.71 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.729 -0.669 . . . . 2.29 111.863 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -84.01 -44.62 13.96 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 112.103 0.408 . . . . 2.29 112.103 174.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.729 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 42.3 mt-10 -66.02 -46.27 78.48 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 113.111 0.782 . . . . 1.3 113.111 -164.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.59 HD22 ' O ' ' A' ' 55' ' ' ASP . 2.5 pt? -53.46 -31.22 44.62 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.014 -0.539 . . . . 1.54 111.347 -173.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 67.2 mtt-85 -64.93 -53.71 42.17 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.549 -0.75 . . . . 2.5800000000000001 111.741 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.719 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 15.3 p90 -90.76 -3.8 57.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.595 -0.275 . . . . 5.3200000000000003 111.119 -176.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 26.4 ttt180 -53.59 -34.87 59.93 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.469 0.544 . . . . 4.4800000000000004 112.469 -172.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 -64.77 -33.88 77.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.992 0.425 . . . . 4.7199999999999998 110.761 177.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.582 ' HB1' HD13 ' A' ' 68' ' ' LEU . . . -78.37 -28.91 47.17 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.891 -0.595 . . . . 1.1699999999999999 110.577 -178.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.573 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 52.7 t80 -44.3 -46.91 9.42 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.543 0.572 . . . . 2.8100000000000001 112.543 -176.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 36.7 t -62.76 -44.68 95.55 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.894 0.378 . . . . 2.1899999999999999 110.744 -177.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.75 -29.12 40.43 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.104 -0.498 . . . . 2.7200000000000002 111.549 -176.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.727 ' HA ' ' HG3' ' A' ' 71' ' ' GLN . 4.1 mp -61.6 -24.37 66.64 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.677 0.621 . . . . 1.5600000000000001 112.677 -175.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.475 HG22 HG13 ' A' ' 74' ' ' ILE . 21.2 p -57.73 -29.13 64.49 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.171 0.51 . . . . 0.69999999999999996 110.719 178.479 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.5 t -76.8 -38.87 53.17 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.566 -0.743 . . . . 1.3400000000000001 109.768 176.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.727 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 6.5 mt-30 -65.63 -47.17 76.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.32 -0.854 . . . . 1.4199999999999999 110.161 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.602 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.2 mt -74.8 -31.4 61.72 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.753 -0.658 . . . . 1.3700000000000001 110.545 178.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.468 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 49.2 m80 71.86 54.64 0.19 Allowed 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.563 0.697 . . . . 2.7200000000000002 109.276 -176.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.478 HG21 ' HB3' ' A' ' 113' ' ' GLU . 15.2 mm -58.58 118.47 2.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 114.165 -1.379 . . . . 0.91000000000000003 110.666 -179.732 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.758 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -156.39 -170.41 0.24 Allowed Pre-proline 0 CA--C 1.546 0.827 0 N-CA-C 107.98 -1.118 . . . . 0.51000000000000001 107.98 -169.214 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.758 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 38.4 Cg_exo -29.47 166.37 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.278 0 C-N-CA 124.814 3.676 . . . . 0.46999999999999997 115.091 163.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -33.24 -24.08 0.01 OUTLIER Glycine 0 N--CA 1.471 1.0 0 N-CA-C 117.259 1.664 . . . . 0.40000000000000002 117.259 -174.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.453 ' N ' ' O ' ' A' ' 76' ' ' PRO . 17.2 p -71.96 6.3 2.17 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 117.994 0.897 . . . . 0.56000000000000005 112.216 179.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.57 -12.64 61.56 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.165 0.507 . . . . 0.34000000000000002 110.19 174.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.453 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 1.8 p90 -76.0 -15.13 60.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.013 -0.539 . . . . 4.1299999999999999 109.841 176.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.472 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 36.3 mt-30 -83.38 -26.31 30.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.451 -0.795 . . . . 1.03 109.793 173.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.544 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.2 m -74.48 -50.12 19.56 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.041 -0.981 . . . . 0.47999999999999998 109.392 172.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -65.54 -18.29 65.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 114.991 -1.004 . . . . 1.1799999999999999 110.06 175.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.574 ' HA ' HG12 ' A' ' 87' ' ' VAL . 37.9 tt0 -62.84 -49.02 76.54 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.258 -0.883 . . . . 0.80000000000000004 110.57 178.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.409 ' O ' ' HG2' ' A' ' 89' ' ' GLU . 73.5 mt-30 -48.1 -36.43 13.2 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.716 -1.129 . . . . 1.6200000000000001 110.125 177.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.79 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.0 OUTLIER -81.37 -54.58 9.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 114.452 -1.249 . . . . 1.3 111.026 -176.108 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.574 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.6 p -59.33 -23.45 25.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 122.038 0.923 . . . . 0.84999999999999998 109.396 -177.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 3.7 m-80 -71.31 -58.46 3.51 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 113.945 -1.48 . . . . 0.91000000000000003 110.894 172.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 1.028 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.0 OUTLIER -62.26 -38.8 90.69 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-O 121.967 0.889 . . . . 2.8700000000000001 109.358 -174.396 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' A' ' 86' ' ' VAL . 1.7 tp -56.12 -30.55 62.25 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 113.194 -1.821 . . . . 1.28 110.912 -179.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.574 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 71.6 t80 -94.35 -33.38 13.2 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.488 -0.324 . . . . 2.2999999999999998 111.839 -168.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.91 -45.99 47.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 122.119 0.961 . . . . 5.0599999999999996 110.213 -175.286 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -95.82 20.63 9.61 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 113.803 -1.544 . . . . 3.1200000000000001 112.568 -159.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.473 ' O ' ' HG2' ' A' ' 99' ' ' ARG . . . 130.16 68.56 0.11 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 118.141 -1.981 . . . . 2.3100000000000001 115.757 174.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.66 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 61.2 t -73.04 98.71 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 118.593 1.196 . . . . 1.0600000000000001 110.23 173.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.598 ' ND2' ' HB3' ' A' ' 99' ' ' ARG . 3.3 p30 -111.98 -174.46 2.47 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.537 -1.21 . . . . 2.1200000000000001 109.24 175.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.643 ' HA ' ' CE2' ' A' ' 151' ' ' PHE . 16.1 m-90 -61.68 -45.62 93.22 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.979 -0.555 . . . . 3.3399999999999999 110.856 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.44 ' C ' HG12 ' B' 1015 ' ' ILE . . . -77.43 -37.0 32.46 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.905 -0.589 . . . . 0.68999999999999995 113.456 -174.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.67 ' NH2' HD11 ' A' ' 138' ' ' LEU . 0.0 OUTLIER -64.83 -29.14 70.09 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 122.433 -0.451 . . . . 4.2400000000000002 110.524 -177.168 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.563 HG22 ' HE1' ' A' ' 104' ' ' PHE . 45.4 mt -68.58 -36.91 76.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 C-N-CA 120.231 -0.587 . . . . 0.44 110.314 179.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.42 HG13 ' O ' ' A' ' 98' ' ' GLY . 0.6 OUTLIER -59.46 -31.46 46.66 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 N-CA-C 109.562 -0.532 . . . . 1.3500000000000001 109.562 175.946 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 99' ' ' ARG . . . -65.74 -35.36 80.5 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.837 -0.62 . . . . 0.44 111.06 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.464 ' HB3' ' O ' ' A' ' 100' ' ' ILE . 17.4 t80 -60.95 -32.78 72.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.114 -0.948 . . . . 1.49 109.95 177.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.721 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 89.1 m-85 -80.27 -35.94 35.23 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.945 -0.57 . . . . 3.29 110.4 175.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.753 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 20.0 m -61.44 -53.58 54.73 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.082 -0.508 . . . . 1.1899999999999999 110.658 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.553 ' HZ ' HD11 ' A' ' 72' ' ' LEU . 32.2 t80 -73.46 -33.61 64.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.06 -0.518 . . . . 2.8900000000000001 110.392 -178.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.474 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -67.93 -44.83 77.29 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.974 -0.631 . . . . 0.29999999999999999 111.835 178.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 1.058 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.22 -31.67 81.37 Favored Glycine 0 N--CA 1.442 -0.914 0 N-CA-C 111.097 -0.801 . . . . 0.23000000000000001 111.097 175.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.573 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -68.52 -34.77 76.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.304 -0.448 . . . . 0.31 109.887 176.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.455 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.2 OUTLIER -64.2 -35.63 81.44 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.909 0.861 . . . . 1.1200000000000001 110.169 -178.52 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.721 ' SG ' HD21 ' A' ' 17' ' ' LEU . 41.4 t -52.55 -49.16 65.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.51 -1.223 . . . . 0.26000000000000001 109.478 172.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 1.018 HG13 ' HZ2' ' A' ' 20' ' ' LYS . 94.5 t -64.59 -37.15 79.32 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.281 0 CA-C-N 116.272 -0.422 . . . . 0.34999999999999998 110.557 175.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.478 ' HB3' HG21 ' A' ' 74' ' ' ILE . 46.5 mt-10 -56.44 -34.85 67.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.96 0.41 . . . . 2.5099999999999998 110.965 176.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.419 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 26.6 m -79.34 -36.75 38.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.366 0.603 . . . . 0.28000000000000003 109.715 179.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.679 HG23 ' O ' ' A' ' 111' ' ' CYS . 98.1 t -69.34 -32.19 52.46 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.993 0.902 . . . . 1.23 109.427 -178.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -56.83 -50.05 73.56 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 113.596 -1.638 . . . . 0.59999999999999998 111.302 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 35.9 mmtt -85.87 13.8 6.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.795 -0.639 . . . . 1.6200000000000001 110.608 -179.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 62.16 48.45 4.97 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.626 0.727 . . . . 1.8799999999999999 110.497 -178.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 31.4 mtm -126.67 44.09 2.96 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.909 -1.145 . . . . 0.31 107.909 -178.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.629 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 12.4 mp0 -61.75 -6.99 2.99 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.927 -1.033 . . . . 1.1499999999999999 113.31 -171.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.511 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 34.2 m -65.55 -25.32 36.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 120.771 0.32 . . . . 0.46000000000000002 111.029 176.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.626 HD13 ' HD2' ' A' ' 125' ' ' ARG . 2.9 mm? -73.89 -25.3 59.95 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 116.563 -0.289 . . . . 0.26000000000000001 110.556 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.714 HG13 ' SG ' ' A' ' 111' ' ' CYS . 53.2 t -44.13 -53.12 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 O-C-N 123.63 0.581 . . . . 0.25 112.211 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.548 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 6.4 t -78.32 -22.2 48.48 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.097 0.475 . . . . 1.3500000000000001 110.687 -177.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.626 ' HD2' HD13 ' A' ' 122' ' ' LEU . 75.1 mtt180 -79.33 -44.87 20.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.093 -0.503 . . . . 2.6699999999999999 110.897 -177.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.679 ' HA ' ' CE3' ' A' ' 129' ' ' TRP . 85.6 mt -56.15 -47.46 80.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.838 -0.619 . . . . 0.23000000000000001 110.781 179.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.571 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -59.2 -35.95 74.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.818 0.342 . . . . 0.28999999999999998 111.024 178.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -58.1 -58.72 7.17 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.58 0.705 . . . . 0.28000000000000003 110.383 175.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.679 ' CE3' ' HA ' ' A' ' 126' ' ' ILE . 16.6 m0 -56.12 -48.46 76.16 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.22 -1.354 . . . . 3.9100000000000001 110.32 -178.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.541 ' SD ' HG22 ' A' ' 126' ' ' ILE . 91.3 mtp -59.06 -55.02 40.49 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.658 -0.701 . . . . 1.0800000000000001 111.787 -176.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.22 -38.66 87.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.137 -0.483 . . . . 0.25 111.42 -177.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 47.8 m -65.66 -47.21 76.28 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.73 -0.388 . . . . 0.40000000000000002 110.7 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.627 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 5.5 m-85 -56.36 -36.06 68.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.3 -0.409 . . . . 3.1299999999999999 110.529 177.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.847 HD13 ' HB3' ' A' ' 5' ' ' ASN . 4.2 tt -62.28 -58.38 7.92 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.786 -0.82 . . . . 0.94999999999999996 108.786 170.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -48.38 -45.66 36.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.338 -0.846 . . . . 0.46000000000000002 112.842 -176.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -88.96 -45.81 9.38 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.056 0.391 . . . . 0.58999999999999997 112.056 -175.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . 0.627 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 31.0 m-70 -91.25 -48.98 6.62 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.414 0.524 . . . . 1.45 112.414 -170.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.764 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -88.52 -44.24 10.82 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 113.819 1.044 . . . . 1.2 113.819 -168.603 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.62 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 34.8 tt0 -43.44 -53.15 12.09 Favored Pre-proline 0 C--N 1.323 -0.566 0 O-C-N 123.831 0.707 . . . . 0.75 112.8 -174.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.654 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 10.8 Cg_endo -54.37 -49.44 16.92 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 121.857 1.705 . . . . 0.56000000000000005 111.574 177.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 5.0 t-105 -55.99 -52.99 62.22 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.556 -0.747 . . . . 1.2 110.341 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.57 HD12 ' HA ' ' A' ' 139' ' ' GLU . 43.6 mt -46.55 -52.29 3.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.804 -0.634 . . . . 0.32000000000000001 111.812 176.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.62 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.8 mm-40 -60.25 -32.09 70.82 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.766 -0.652 . . . . 0.56999999999999995 111.782 -179.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.654 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.6 mm-40 -65.44 -21.43 66.65 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 121.659 0.742 . . . . 0.78000000000000003 110.464 177.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -107.87 9.57 28.77 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.019 -0.991 . . . . 0.93000000000000005 110.016 -174.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 121.46 -29.37 5.7 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.902 -1.045 . . . . 0.56000000000000005 113.38 171.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 108.64 166.11 20.89 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.649 -0.786 . . . . 0.48999999999999999 111.227 -175.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.786 ' HZ2' HD11 ' A' ' 134' ' ' LEU . 16.9 m95 -57.16 -40.39 77.15 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.82 0.674 . . . . 3.5699999999999998 112.82 -174.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.534 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 9.9 m-20 -55.35 -41.61 72.76 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.303 -0.258 . . . . 1.96 110.303 177.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.606 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 23.4 m -56.58 -38.55 72.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.234 -0.439 . . . . 0.67000000000000004 111.508 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.643 ' CE2' ' HA ' ' A' ' 97' ' ' TRP . 1.2 m-85 -61.29 -36.77 81.0 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.543 0.687 . . . . 3.0 109.44 -178.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.566 HG12 ' HA ' ' A' ' 46' ' ' VAL . 0.7 OUTLIER -80.32 -25.41 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 115.382 -0.827 . . . . 1.1499999999999999 110.042 178.115 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.534 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 6.6 mm-40 -64.56 -29.73 70.75 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.135 0.493 . . . . 1.6699999999999999 109.902 173.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 150' ' ' THR . 9.5 mt -82.96 -56.44 3.81 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.633 -0.712 . . . . 1.3 110.164 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . 0.429 ' HE2' ' HB2' ' A' ' 52' ' ' GLU . 62.5 t80 -113.48 -44.93 3.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.296 -0.411 . . . . 4.2400000000000002 110.752 -176.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.695 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . 43.36 -157.15 0.12 Allowed Glycine 0 CA--C 1.502 -0.746 0 CA-C-O 121.769 0.65 . . . . 1.1000000000000001 113.829 -177.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.65 ' ND2' HE21 ' A' ' 48' ' ' GLN . 27.4 t-20 -112.02 108.2 17.43 Favored 'General case' 0 N--CA 1.426 -1.636 0 CA-C-N 114.776 -0.712 . . . . 1.29 109.745 178.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.694 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 8.9 m120 -74.72 -25.11 58.9 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.081 -0.508 . . . . 2.9900000000000002 111.421 -175.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -56.43 -35.68 68.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.07 0.462 . . . . 2.52 110.541 176.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -87.62 -39.63 14.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.041 -0.527 . . . . 2.8700000000000001 110.481 174.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.683 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -53.7 -63.27 1.2 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.713 -0.676 . . . . 3.2000000000000002 111.894 -177.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.694 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 11.1 pt-20 -66.11 -22.47 66.4 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 120.989 -0.284 . . . . 3.7200000000000002 111.529 -177.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 44.3 t -64.44 -46.95 80.95 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 109.804 -0.443 . . . . 4.1799999999999997 109.804 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 11.1 mpt_? -84.55 -13.46 51.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.36 0.6 . . . . 5.8200000000000003 110.371 179.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.618 ' HB3' ' HA ' ' A' ' 162' ' ' GLU . 39.5 ttmt -82.64 -25.58 32.99 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.432 -0.804 . . . . 4.7699999999999996 110.478 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -61.64 -38.04 95.21 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.796 -0.638 . . . . 5.0999999999999996 112.575 -177.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -75.75 -20.69 58.11 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.948 0.404 . . . . 5.7199999999999998 110.709 177.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -80.46 -2.78 47.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.157 -0.474 . . . . 5.8799999999999999 110.122 176.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.437 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 3.9 tmt_? -73.45 -36.14 65.85 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.537 -0.912 . . . . 7.3399999999999999 108.537 176.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -76.9 -26.0 53.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.505 -0.77 . . . . 6.9699999999999998 109.558 176.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -86.19 -175.84 5.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.415 -0.811 . . . . 6.9699999999999998 109.235 174.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 35.2 t60 -139.21 88.55 2.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.147 0.498 . . . . 9.3499999999999996 109.916 173.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . 0.409 ' O ' ' HB3' ' A' ' 174' ' ' HIS . 11.7 t60 -103.58 141.86 35.29 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.146 -0.687 . . . . 11.4 109.146 178.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . 0.409 ' HB3' ' O ' ' A' ' 173' ' ' HIS . 57.3 t-80 72.86 136.8 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 O-C-N 123.981 0.801 . . . . 11.52 110.449 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -109.66 131.43 55.07 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.101 0.476 . . . . 14.48 110.998 -177.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 16.6 t60 -102.61 105.15 15.6 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.882 -0.784 . . . . 15.369999999999999 108.882 174.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 22.7 p80 -80.24 139.21 36.8 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.962 0.41 . . . . 16.02 110.635 -177.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 42.3 mt -82.94 166.73 18.63 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.878 -0.786 . . . . 17.989999999999998 108.878 175.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 66.71 112.63 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 O-C-N 123.678 0.611 . . . . 19.190000000000001 111.042 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 28.4 m-70 -83.81 -171.8 3.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.976 -0.557 . . . . 22.260000000000002 110.138 177.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -115.04 158.29 22.32 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.282 -0.417 . . . . 22.510000000000002 110.035 178.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -85.31 -42.87 14.22 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.854 -0.424 . . . . 24.890000000000001 109.854 -178.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -77.31 119.12 20.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.953 -0.567 . . . . 25.579999999999998 109.725 175.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -107.41 130.72 54.78 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.453 -0.573 . . . . 27.370000000000001 109.453 178.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 80.9 t60 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.764 -0.636 . . . . 29.059999999999999 110.338 -178.761 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . 0.479 ' H1 ' ' HA ' ' A' ' 71' ' ' GLN . . . . . . . . 0 C--O 1.234 0.255 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -103.61 -143.58 12.85 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.941 -0.647 . . . . 2.9700000000000002 112.039 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.515 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . 59.7 m 61.39 -158.71 0.33 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 120.618 0.247 . . . . 1.9399999999999999 110.514 -179.167 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . . . . . . . . . 22.8 m 63.05 -20.27 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 N-CA-C 116.461 2.023 . . . . 1.6299999999999999 116.461 162.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 0.936 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . -94.42 5.25 70.64 Favored Glycine 0 N--CA 1.439 -1.165 0 C-N-CA 119.925 -1.131 . . . . 1.2 110.366 153.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . 0.442 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 7.4 mpt_? -121.46 -32.29 3.87 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 122.952 0.501 . . . . 2.8799999999999999 111.878 174.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . 0.582 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -82.26 -54.14 5.48 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.256 -0.429 . . . . 1.3100000000000001 112.114 -167.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.567 ' H ' HD22 ' B' 1008 ' ' LEU . 2.2 mm? -70.03 -31.69 69.45 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.076 -0.713 . . . . 1.3300000000000001 109.076 -177.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 1.028 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -49.89 -45.34 50.66 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.367 -1.288 . . . . 0.88 109.782 172.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.886 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -85.23 -49.41 8.22 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 113.178 -1.828 . . . . 1.03 111.498 -174.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.62 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 49.7 m-85 -65.58 -23.56 66.87 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.048 -0.524 . . . . 1.6699999999999999 110.498 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.82 -11.35 83.52 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.932 -0.576 . . . . 0.78000000000000003 112.934 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 32.6 t70 -71.84 -15.43 62.13 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.5 0.667 . . . . 1.8999999999999999 109.654 170.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 32.6 m -111.35 82.27 1.58 Allowed 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.553 -0.749 . . . . 1.4399999999999999 110.223 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.637 ' H ' HD12 ' B' 1015 ' ' ILE . 0.8 OUTLIER -95.28 -96.01 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 108.521 -0.918 . . . . 2.9100000000000001 108.521 175.903 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . 0.497 ' H ' ' HB ' ' B' 1015 ' ' ILE . 27.4 p-10 -84.02 -7.7 59.33 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.732 -0.84 . . . . 4.29 108.732 170.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 72.8 mtp180 -96.89 86.78 4.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.844 -1.071 . . . . 8.1699999999999999 110.169 -179.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.694 0 CA-C-N 116.524 -0.307 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.886 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.9 ptp . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 109.992 -0.373 . . . . 6.21 109.992 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.0 m -67.11 -35.3 79.47 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.108 0.48 . . . . 1.8700000000000001 110.953 -178.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.726 ' HB3' ' HB3' ' A' ' 36' ' ' GLU . 26.3 mp0 -64.77 -10.65 29.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.968 -0.56 . . . . 2.4199999999999999 111.072 -179.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.3 m -82.13 -17.92 44.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.167 -0.469 . . . . 1.25 111.068 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.767 ' HA ' HD22 ' A' ' 8' ' ' LEU . 76.2 m-20 -62.64 -22.1 66.18 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 121.218 0.532 . . . . 1.78 109.756 177.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.547 ' HA ' ' CB ' ' A' ' 131' ' ' ALA . 11.7 tpp85 -57.78 -43.53 85.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.276 -0.875 . . . . 1.3999999999999999 110.573 176.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -61.58 -49.16 77.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.71 -0.677 . . . . 0.68000000000000005 111.242 -177.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.767 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.3 OUTLIER -50.04 -32.99 16.83 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.129 -0.942 . . . . 1.1599999999999999 111.383 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.449 HG11 ' HA ' ' A' ' 127' ' ' ALA . 79.5 t -79.53 -62.25 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.79 -0.641 . . . . 0.27000000000000002 110.24 173.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.532 HG13 ' CE2' ' A' ' 24' ' ' TRP . 73.2 t -48.58 -54.73 4.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.504 -0.771 . . . . 0.33000000000000002 112.553 -176.159 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -57.08 -37.49 71.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.094 -0.503 . . . . 0.58999999999999997 110.524 -177.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.744 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 19.2 t80 -69.8 -46.49 65.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.939 -0.573 . . . . 1.6100000000000001 110.501 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 1.056 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.9 mp -62.01 -39.48 92.39 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 120.98 -0.288 . . . . 0.34000000000000002 110.45 178.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.3 m -58.63 -42.21 87.73 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.395 0.617 . . . . 1.05 110.205 176.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -67.47 -17.84 64.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.108 -0.951 . . . . 1.22 111.108 -178.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.632 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.4 mmpt? -85.96 -49.1 8.1 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.525 0.679 . . . . 1.4099999999999999 109.777 -178.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.582 HD21 ' SG ' ' A' ' 111' ' ' CYS . 12.4 mt -59.33 -28.31 66.7 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.965 -1.016 . . . . 1.3500000000000001 111.26 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.3 t -56.82 -43.88 81.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.427 -0.806 . . . . 0.93999999999999995 111.678 177.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 12.4 pt20 -80.64 2.02 27.53 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.995 0.426 . . . . 1.3700000000000001 111.587 -178.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.764 ' HE2' HG11 ' A' ' 112' ' ' VAL . 20.7 mmmt -107.39 -28.54 9.79 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.913 0.863 . . . . 2.2000000000000002 109.032 179.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 22.25 10.4 Favored Glycine 0 N--CA 1.441 -0.999 0 CA-C-N 113.888 -1.505 . . . . 0.53000000000000003 111.576 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -113.61 161.73 17.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.862 0.363 . . . . 0.76000000000000001 110.691 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.3 t -102.33 145.94 28.75 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.998 -0.546 . . . . 0.52000000000000002 110.259 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.532 ' CE2' HG13 ' A' ' 10' ' ' VAL . 48.2 t-105 -75.09 -51.77 12.68 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.598 -0.728 . . . . 3.3599999999999999 109.192 174.471 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.407 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 4.8 m -60.01 -34.48 73.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.378 -0.828 . . . . 1.3700000000000001 111.976 -174.239 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -61.45 -28.78 69.52 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.781 0.325 . . . . 1.1100000000000001 111.536 -179.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -120.85 19.06 11.8 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.192 -0.458 . . . . 1.28 111.253 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.545 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 53.7 p -99.81 -178.72 3.95 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.592 0.71 . . . . 1.8100000000000001 112.034 -172.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.527 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.0 OUTLIER -165.43 -25.69 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.429 -1.26 . . . . 2.3100000000000001 109.304 -179.364 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.915 HG23 ' H ' ' A' ' 31' ' ' GLU . 10.7 m -50.63 -71.89 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 114.387 -1.279 . . . . 0.92000000000000004 112.864 -173.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.915 ' H ' HG23 ' A' ' 30' ' ' VAL . 9.0 pt-20 -94.82 0.38 54.82 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.929 -0.767 . . . . 2.7400000000000002 108.929 177.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.527 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 30.5 tt0 -70.61 -53.46 15.84 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.671 -1.15 . . . . 1.45 110.577 -178.008 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -97.21 -37.42 10.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.867 -0.606 . . . . 1.8700000000000001 111.402 -175.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.408 ' O ' ' HA ' ' A' ' 31' ' ' GLU . 25.1 ptt180 -124.17 144.81 49.7 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.077 0.465 . . . . 3.3900000000000001 111.185 179.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.2 p -116.76 111.93 20.45 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.51 0.672 . . . . 2.25 110.695 178.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.726 ' HB3' ' HB3' ' A' ' 3' ' ' GLN . 8.9 mm-40 -85.81 -71.75 0.52 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.349 -0.841 . . . . 3.3399999999999999 110.7 -177.092 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.465 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -100.06 170.84 6.2 Favored Pre-proline 0 C--N 1.319 -0.75 0 CA-C-N 115.811 -0.631 . . . . 1.9199999999999999 110.194 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.574 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 75.7 Cg_exo -53.21 170.4 0.34 Allowed 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.881 2.388 . . . . 1.8700000000000001 111.695 170.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -72.44 0.62 9.75 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 122.186 -0.321 . . . . 4.6399999999999997 111.01 -179.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.432 ' HA2' ' OG ' ' A' ' 43' ' ' SER . . . 159.02 70.15 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.801 0 CA-C-N 115.901 -0.591 . . . . 2.1499999999999999 111.734 176.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.645 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.5 OUTLIER -74.57 -73.06 0.25 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 120.754 -0.378 . . . . 1.1200000000000001 110.757 -177.894 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.645 ' H ' HG23 ' A' ' 41' ' ' THR . 0.0 OUTLIER -91.85 -35.36 14.12 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 121.717 0.77 . . . . 2.02 109.486 172.883 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.745 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 27.9 p -54.42 -36.96 64.55 Favored 'General case' 0 C--O 1.212 -0.886 0 CA-C-N 114.19 -1.368 . . . . 1.25 113.122 -171.044 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -42.6 -40.49 2.71 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.694 0.627 . . . . 1.9099999999999999 112.694 -171.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.582 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -87.51 -36.18 17.78 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 121.926 -0.484 . . . . 0.52000000000000002 111.543 178.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.697 HG13 ' HA ' ' A' ' 43' ' ' SER . 0.7 OUTLIER -72.63 -37.07 55.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.894 -0.139 . . . . 1.4099999999999999 111.18 -177.801 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.745 ' HG2' ' O ' ' A' ' 43' ' ' SER . 17.8 ptpt -67.15 -40.22 86.66 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.018 -0.734 . . . . 0.67000000000000004 109.018 175.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.62 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 5.9 mm100 -63.28 -34.62 78.07 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.317 -0.856 . . . . 0.98999999999999999 110.953 176.118 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.51 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -72.67 -38.21 67.67 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.192 0.52 . . . . 0.41999999999999998 110.841 178.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 mp -69.96 -23.88 63.25 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.624 -0.716 . . . . 1.3300000000000001 112.508 -174.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.599 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 9.3 ptp180 -84.92 -25.49 27.87 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.95 0.881 . . . . 2.1699999999999999 109.054 -175.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.62 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 10.7 mm-40 -78.05 -45.34 23.86 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 114.233 -1.349 . . . . 1.1000000000000001 110.202 176.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.03 -40.57 91.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.005 -0.543 . . . . 0.53000000000000003 110.129 174.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.737 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -60.35 -41.0 98.27 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 115.778 -0.646 . . . . 0.69999999999999996 112.03 178.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.469 ' O ' HD22 ' A' ' 59' ' ' LEU . 19.6 t70 -55.09 -35.31 64.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.984 0.421 . . . . 1.04 110.767 -179.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.449 ' O ' HD21 ' A' ' 59' ' ' LEU . 29.4 mm-40 -73.3 -25.96 60.87 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.337 -0.847 . . . . 2.29 111.898 179.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.463 ' HE1' ' HA2' ' B' 1012 ' ' GLY . 66.2 t80 -83.51 -33.31 25.56 Favored 'General case' 0 C--N 1.316 -0.858 0 O-C-N 122.205 -0.309 . . . . 2.29 111.703 177.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.737 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 39.6 mt-10 -66.34 -54.02 29.41 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.575 0.583 . . . . 1.3 112.575 -167.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.562 HD23 ' N ' ' A' ' 59' ' ' LEU . 2.1 pt? -53.75 -36.67 62.58 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.696 -0.684 . . . . 1.54 110.775 -176.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 64.9 mtt180 -52.94 -55.65 21.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.54 -0.754 . . . . 2.5800000000000001 111.717 -178.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.638 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 47.9 p90 -90.72 -4.5 56.66 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 121.134 -0.227 . . . . 5.3200000000000003 111.119 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 53.3 ttp180 -54.34 -30.4 51.37 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 122.769 0.428 . . . . 4.4800000000000004 111.646 -177.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.585 ' HD2' ' H ' ' A' ' 63' ' ' ARG . 3.3 mpt_? -66.54 -35.28 79.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.987 0.422 . . . . 4.7199999999999998 110.641 179.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.538 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.35 -27.57 17.46 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.051 -0.522 . . . . 1.1699999999999999 111.991 -179.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.58 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 51.6 t80 -41.67 -48.54 4.15 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 114.184 1.179 . . . . 2.8100000000000001 114.184 -169.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 23.3 t -63.91 -44.25 93.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.932 0.396 . . . . 2.1899999999999999 110.682 -173.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -72.63 -32.57 66.01 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.97 -0.559 . . . . 2.7200000000000002 111.067 -179.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.579 HD22 ' NE2' ' A' ' 71' ' ' GLN . 14.5 mt -58.87 -23.53 61.03 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 112.929 0.714 . . . . 1.5600000000000001 112.929 -174.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.444 HG22 HG13 ' A' ' 74' ' ' ILE . 16.9 p -57.39 -26.27 60.82 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 118.33 0.514 . . . . 0.69999999999999996 111.217 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.4 t -73.35 -24.81 60.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.712 -0.676 . . . . 1.3400000000000001 109.938 177.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.579 ' NE2' HD22 ' A' ' 68' ' ' LEU . 16.3 mt-30 -87.41 -40.06 14.72 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.456 -0.793 . . . . 1.4199999999999999 110.163 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.652 HD21 ' HZ ' ' A' ' 106' ' ' PHE . 3.3 mm? -65.56 -32.55 74.21 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 109.746 -0.465 . . . . 1.3700000000000001 109.746 173.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 72.7 t60 66.33 44.33 2.48 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 107.673 -1.232 . . . . 2.7200000000000002 107.673 -173.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.598 HG22 ' HE1' ' A' ' 119' ' ' MET . 26.3 mm -51.35 118.33 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 113.759 -1.564 . . . . 0.91000000000000003 111.541 -179.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.773 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -160.32 -171.82 0.3 Allowed Pre-proline 0 C--N 1.316 -0.877 0 N-CA-C 107.301 -1.37 . . . . 0.51000000000000001 107.301 -170.838 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.773 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 39.2 Cg_exo -29.07 165.36 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 125.07 3.847 . . . . 0.46999999999999997 115.576 165.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.43 -28.53 0.01 OUTLIER Glycine 0 N--CA 1.475 1.279 0 N-CA-C 117.826 1.891 . . . . 0.40000000000000002 117.826 -172.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.45 ' N ' ' O ' ' A' ' 76' ' ' PRO . 35.1 p -69.13 6.92 0.83 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 118.21 1.005 . . . . 0.56000000000000005 112.476 -179.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.81 -11.84 60.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.244 0.545 . . . . 0.34000000000000002 110.192 174.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -76.52 -18.06 58.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.961 -0.563 . . . . 4.1299999999999999 109.673 175.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.431 ' HA ' ' HB2' ' A' ' 84' ' ' GLU . 32.8 mt-30 -84.27 -24.22 30.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.895 0.855 . . . . 1.03 109.329 173.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 8.5 m -71.48 -50.46 31.38 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.542 -1.208 . . . . 0.47999999999999998 109.23 170.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -67.85 -18.69 64.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.252 -0.886 . . . . 1.1799999999999999 110.167 175.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.585 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.7 tt0 -59.73 -52.17 66.63 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-O 121.605 0.717 . . . . 0.80000000000000004 110.026 179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.427 ' O ' ' HG2' ' A' ' 89' ' ' GLU . 57.4 mm-40 -47.47 -35.07 8.12 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 113.707 -1.588 . . . . 1.6200000000000001 110.781 177.428 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.861 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -86.36 -49.76 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.889 0 CA-C-N 114.519 -1.219 . . . . 1.3 111.054 -175.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.585 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.7 p -62.81 -22.72 31.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.979 0.895 . . . . 0.84999999999999998 109.361 -178.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.606 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 2.6 m-80 -71.08 -52.21 20.73 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.306 -1.315 . . . . 0.91000000000000003 111.146 174.225 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 1.028 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.0 OUTLIER -67.51 -38.22 83.98 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-O 121.754 0.787 . . . . 2.8700000000000001 109.346 -177.039 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.463 ' HG ' ' OE2' ' A' ' 89' ' ' GLU . 18.2 mt -63.01 -24.87 68.12 Favored 'General case' 0 N--CA 1.432 -1.369 0 CA-C-N 113.867 -1.515 . . . . 1.28 111.46 -178.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.651 ' HA ' HG22 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -110.27 -40.61 4.63 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 112.588 0.588 . . . . 2.2999999999999998 112.588 -170.558 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.606 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER -67.8 -29.83 69.11 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.316 0.579 . . . . 5.0599999999999996 110.784 -171.318 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.528 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 1.2 m-20 -98.88 17.22 20.05 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.353 -0.84 . . . . 3.1200000000000001 112.972 -172.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.594 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 126.38 71.75 0.19 Allowed Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 117.18 -2.438 . . . . 2.3100000000000001 115.758 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.651 HG22 ' HA ' ' A' ' 91' ' ' PHE . 57.8 t -71.42 102.73 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-N 118.977 1.388 . . . . 1.0600000000000001 110.698 177.022 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -112.16 -172.53 2.06 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.848 -1.069 . . . . 2.1200000000000001 110.143 -178.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.703 ' HD1' ' HB3' ' A' ' 145' ' ' ASN . 74.0 t90 -51.46 -49.43 61.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.408 -0.814 . . . . 3.3399999999999999 111.799 -179.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -86.36 -14.42 66.22 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 120.775 -0.726 . . . . 0.68999999999999995 114.04 -174.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 94' ' ' GLY . 24.9 mmt180 -64.17 -45.01 90.27 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 117.459 0.63 . . . . 4.2400000000000002 111.398 -176.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.643 ' HA ' ' CD1' ' A' ' 103' ' ' PHE . 66.7 mt -60.0 -30.83 46.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.51 -0.768 . . . . 0.44 111.542 -174.397 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 36.3 t -56.58 -54.63 26.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.653 -0.703 . . . . 1.3500000000000001 110.384 171.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -52.78 -40.99 63.68 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.304 -0.862 . . . . 0.44 111.875 -178.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.643 ' CD1' ' HA ' ' A' ' 100' ' ' ILE . 68.1 m-85 -50.42 -56.69 10.33 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.311 0.577 . . . . 1.49 110.56 177.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.634 ' HD1' ' HE3' ' A' ' 130' ' ' MET . 17.7 m-85 -75.57 -27.4 58.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.546 -0.752 . . . . 3.29 111.178 -174.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.744 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 47.2 m -62.81 -46.36 88.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.863 0.364 . . . . 1.1899999999999999 110.452 178.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.652 ' HZ ' HD21 ' A' ' 72' ' ' LEU . 56.5 t80 -80.84 -32.36 35.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.232 -0.44 . . . . 2.8900000000000001 110.483 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.781 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.93 -40.42 95.37 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.64 -0.791 . . . . 0.29999999999999999 111.9 176.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 1.056 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.51 -31.0 75.59 Favored Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 111.152 -0.779 . . . . 0.23000000000000001 111.152 174.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.58 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -72.42 -32.66 66.52 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 110.02 -0.363 . . . . 0.31 110.02 176.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.433 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.2 OUTLIER -65.66 -36.23 83.06 Favored 'General case' 0 CA--C 1.511 -0.55 0 CA-C-O 121.833 0.825 . . . . 1.1200000000000001 110.123 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.738 ' HB2' HD23 ' A' ' 13' ' ' LEU . 35.8 t -50.55 -48.01 57.51 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-N 114.468 -1.242 . . . . 0.26000000000000001 109.233 172.06 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.764 HG11 ' HE2' ' A' ' 20' ' ' LYS . 92.3 t -71.04 -32.64 48.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.599 -0.728 . . . . 0.34999999999999998 110.879 177.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.433 ' OE2' ' HA ' ' A' ' 110' ' ' LEU . 40.0 mt-10 -57.27 -34.46 68.66 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.26 0.552 . . . . 2.5099999999999998 110.223 174.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.459 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 16.6 m -77.21 -35.06 55.97 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 115.682 -0.69 . . . . 0.28000000000000003 109.312 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 111' ' ' CYS . 86.9 t -69.04 -35.21 67.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 121.91 0.862 . . . . 1.23 109.344 -179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -53.49 -49.28 67.84 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 113.547 -1.66 . . . . 0.59999999999999998 111.374 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -88.15 13.09 12.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.856 -0.611 . . . . 1.6200000000000001 110.387 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 61.09 52.34 4.06 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.723 0.773 . . . . 1.8799999999999999 110.335 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.598 ' HE1' HG22 ' A' ' 74' ' ' ILE . 28.7 mtm -130.96 44.37 2.97 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 107.781 -1.192 . . . . 0.31 107.781 -179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.659 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 15.1 mp0 -60.02 -6.66 1.43 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.746 -1.116 . . . . 1.1499999999999999 113.465 -172.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.559 HG23 HD22 ' A' ' 122' ' ' LEU . 31.4 m -65.96 -26.63 38.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 121.943 -0.473 . . . . 0.46000000000000002 111.553 175.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.722 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.1 mm? -71.85 -27.13 62.68 Favored 'General case' 0 CA--C 1.505 -0.775 0 N-CA-C 110.373 -0.232 . . . . 0.26000000000000001 110.373 -179.11 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.707 HG13 ' SG ' ' A' ' 111' ' ' CYS . 41.0 t -39.07 -55.56 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 O-C-N 124.33 1.019 . . . . 0.25 112.736 177.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.545 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 5.7 t -77.9 -30.54 50.71 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.642 -0.423 . . . . 1.3500000000000001 110.773 -177.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.722 ' HD2' HD13 ' A' ' 122' ' ' LEU . 88.0 mtt180 -66.57 -48.78 68.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.204 -0.453 . . . . 2.6699999999999999 110.997 -176.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.451 HD12 ' HA ' ' A' ' 111' ' ' CYS . 75.3 mt -53.66 -49.9 53.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.731 -0.668 . . . . 0.23000000000000001 110.874 178.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.556 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.53 -36.99 69.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.996 -0.547 . . . . 0.28999999999999998 112.046 -178.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -57.13 -57.85 10.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.459 0.647 . . . . 0.28000000000000003 110.91 178.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -65.5 -37.32 86.45 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.695 -1.139 . . . . 3.9100000000000001 111.02 -176.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.781 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 0.4 OUTLIER -61.9 -48.63 79.58 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.034 0.445 . . . . 1.0800000000000001 111.091 179.712 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.547 ' CB ' ' HA ' ' A' ' 6' ' ' ARG . . . -67.75 -37.81 82.63 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 0.25 111.227 -178.059 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 96.9 m -65.57 -45.62 82.59 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.794 -0.363 . . . . 0.40000000000000002 110.982 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.42 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 49.1 t80 -56.47 -43.36 79.53 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.554 -0.536 . . . . 3.1299999999999999 109.554 177.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.985 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.4 OUTLIER -54.9 -61.33 2.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.764 -0.653 . . . . 0.94999999999999996 109.786 170.992 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . 0.404 ' HA ' HD22 ' A' ' 5' ' ' ASN . 4.8 m-80 -43.9 -56.17 4.08 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.3 -0.864 . . . . 0.46000000000000002 112.808 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -76.94 -51.37 11.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.117 0.484 . . . . 0.58999999999999997 111.925 -174.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . 0.42 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 0.4 OUTLIER -92.0 -51.56 5.14 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 112.982 0.734 . . . . 1.45 112.982 -170.261 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.985 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -79.51 -42.18 25.77 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 114.492 1.293 . . . . 1.2 114.492 -165.718 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.532 ' HB3' ' HD3' ' A' ' 140' ' ' PRO . 29.2 tt0 -44.09 -48.99 23.21 Favored Pre-proline 0 N--CA 1.472 0.643 0 N-CA-C 112.906 0.706 . . . . 0.75 112.906 -174.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.585 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.0 Cg_exo -52.91 -46.77 31.46 Favored 'Trans proline' 0 C--N 1.356 0.957 0 C-N-CA 121.949 1.766 . . . . 0.56000000000000005 111.952 175.321 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -48.84 78.71 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.801 -0.636 . . . . 1.2 110.921 178.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.553 HD12 ' O ' ' A' ' 138' ' ' LEU . 1.7 mp -49.73 -47.75 21.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.142 0.496 . . . . 0.32000000000000001 110.694 177.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.509 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 70.8 mm-40 -64.44 -29.59 70.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.538 -0.756 . . . . 0.56999999999999995 111.991 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 19.1 mm-40 -62.15 -24.13 66.99 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.784 0.802 . . . . 0.78000000000000003 110.006 176.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.703 ' HB3' ' HD1' ' A' ' 97' ' ' TRP . 23.0 m-80 -104.89 10.98 34.15 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.5 -1.227 . . . . 0.93000000000000005 109.715 -174.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 106.56 -12.54 42.89 Favored Glycine 0 N--CA 1.439 -1.164 0 CA-C-N 114.618 -1.174 . . . . 0.56000000000000005 113.116 174.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.517 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 102.29 174.45 27.44 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.366 -0.921 . . . . 0.48999999999999999 112.098 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.411 ' HB3' ' CB ' ' A' ' 46' ' ' VAL . 56.0 m95 -63.97 -42.95 97.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.712 0.291 . . . . 3.5699999999999998 110.936 -178.239 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.487 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 26.9 t70 -53.8 -48.99 69.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.609 . . . . 1.96 110.882 177.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.556 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 67.9 m -58.9 -34.6 71.87 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.724 -0.671 . . . . 0.67000000000000004 111.501 179.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -60.45 -45.27 94.29 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.698 -0.482 . . . . 3.0 109.698 -179.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.582 HG21 ' HB1' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -72.62 -26.78 24.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.186 -0.461 . . . . 1.1499999999999999 110.314 178.0 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 18.5 mm-40 -60.98 -29.98 70.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.952 0.406 . . . . 1.6699999999999999 110.244 173.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.9 mt -94.1 -60.25 1.78 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.146 -0.479 . . . . 1.3 110.959 -179.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . 0.687 ' HB2' ' HH2' ' A' ' 97' ' ' TRP . 3.2 t80 -121.05 26.37 9.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.338 0.59 . . . . 4.2400000000000002 110.468 -172.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.51 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -61.45 162.59 24.39 Favored Glycine 0 CA--C 1.499 -0.966 0 CA-C-N 115.716 -0.675 . . . . 1.1000000000000001 112.83 178.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.579 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 26.4 t-20 -55.6 111.58 0.93 Allowed 'General case' 0 C--N 1.309 -1.193 0 CA-C-N 114.12 -1.04 . . . . 1.29 110.754 178.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.43 ' ND2' ' HG3' ' A' ' 162' ' ' GLU . 10.5 t30 -100.43 -3.61 30.62 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-O 121.32 0.581 . . . . 2.9900000000000002 109.918 -176.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -59.82 -47.2 86.68 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.004 -0.544 . . . . 2.52 110.271 175.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -63.98 -36.44 83.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.809 -0.632 . . . . 2.8700000000000001 110.369 174.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -59.12 -48.33 81.98 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.558 -0.746 . . . . 3.2000000000000002 110.768 178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.43 ' HG3' ' ND2' ' A' ' 158' ' ' ASN . 45.0 mt-10 -68.61 -31.72 71.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.959 -0.564 . . . . 3.7200000000000002 111.234 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 70.1 m -61.43 -47.61 84.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.936 0.398 . . . . 4.1799999999999997 110.849 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -90.89 0.04 57.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.495 -0.32 . . . . 5.8200000000000003 111.798 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -63.27 -43.14 98.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.641 0.258 . . . . 4.7699999999999996 111.61 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -57.79 -59.45 10.81 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.204 -0.522 . . . . 5.0999999999999996 112.832 -175.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.507 ' HB2' ' CE1' ' A' ' 175' ' ' HIS . 12.0 pt20 -71.89 -17.21 62.13 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 111.979 0.362 . . . . 5.7199999999999998 111.979 -177.111 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -69.57 -18.12 63.61 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.343 0.592 . . . . 5.8799999999999999 110.049 177.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.641 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 1.1 tmt_? -91.19 -17.8 25.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.347 0.594 . . . . 7.3399999999999999 109.442 -177.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 170' ' ' LEU . 4.0 mm? -87.17 28.97 0.87 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.865 -0.607 . . . . 6.9699999999999998 111.045 -177.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -85.8 -0.28 54.87 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.854 -0.612 . . . . 6.9699999999999998 110.699 -177.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -73.84 -6.67 48.49 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.235 0.541 . . . . 9.3499999999999996 110.388 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -158.27 173.18 17.08 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.367 -0.975 . . . . 11.4 108.367 176.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -80.68 91.8 5.91 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 119.975 -0.69 . . . . 11.52 110.094 179.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . 0.507 ' CE1' ' HB2' ' A' ' 167' ' ' GLN . 6.4 p80 -77.87 136.91 38.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.739 -0.664 . . . . 14.48 110.156 -178.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 14.3 m-70 -96.09 -52.57 3.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.562 -0.29 . . . . 15.369999999999999 110.994 -177.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 85.7 t60 61.69 96.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 O-C-N 123.858 0.724 . . . . 16.02 110.667 -176.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 89.7 mt -69.66 130.1 41.45 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.772 -0.649 . . . . 17.989999999999998 110.542 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -113.43 104.65 12.5 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.802 -0.635 . . . . 19.190000000000001 109.413 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 47.3 t-80 -91.84 102.69 15.29 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.242 0.544 . . . . 22.260000000000002 110.734 -176.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -132.23 -26.2 1.91 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.664 -0.698 . . . . 22.510000000000002 109.761 176.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 38.4 m80 -79.98 138.24 37.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.062 -0.517 . . . . 24.890000000000001 110.317 177.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -103.98 -178.78 3.76 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.021 -0.536 . . . . 25.579999999999998 110.462 -177.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 37.8 p-80 -143.59 129.42 19.39 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.364 -0.38 . . . . 27.370000000000001 110.077 175.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 42.6 t60 . . . . . 0 C--O 1.247 0.926 0 CA-C-O 118.322 -0.847 . . . . 29.059999999999999 109.557 -179.743 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.239 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -83.03 57.2 5.08 Favored Glycine 0 N--CA 1.451 -0.341 0 O-C-N 121.561 -0.712 . . . . 2.9700000000000002 112.078 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.513 ' O ' HG22 ' B' 1004 ' ' VAL . 22.3 m -119.89 -140.31 0.34 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 110.032 -0.359 . . . . 1.9399999999999999 110.032 -178.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.536 ' C ' ' H ' ' B' 1006 ' ' ARG . 1.7 m 52.13 -178.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 C-N-CA 125.11 1.364 . . . . 1.6299999999999999 111.761 -174.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 0.904 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . 46.25 5.35 0.01 OUTLIER Glycine 0 CA--C 1.541 1.679 0 C-N-CA 120.93 -0.652 . . . . 1.2 114.188 -160.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . 0.536 ' H ' ' C ' ' B' 1004 ' ' VAL . 24.2 mmt180 -139.51 -41.58 0.45 Allowed 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 123.446 0.698 . . . . 2.8799999999999999 109.754 177.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . 0.526 ' O ' ' HD1' ' B' 1011 ' ' PHE . . . -59.9 -61.06 2.89 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 116.19 -0.459 . . . . 1.3100000000000001 111.307 -177.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.838 ' H ' HD22 ' B' 1008 ' ' LEU . 1.0 OUTLIER -63.45 -39.8 95.43 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.49 -0.93 . . . . 1.3300000000000001 108.49 -179.19 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 1.028 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -48.6 -49.97 34.6 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.521 -1.218 . . . . 0.88 110.58 172.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.91 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -78.18 -43.52 28.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 114.704 -1.135 . . . . 1.03 112.021 -175.136 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.603 ' HE1' ' H8 ' ' B' 1100 ' ' 33B . 46.3 m-85 -67.14 -26.73 66.82 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.223 0.535 . . . . 1.6699999999999999 110.42 178.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . 0.463 ' HA2' ' HE1' ' A' ' 57' ' ' PHE . . . -79.93 -6.77 88.98 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.45 -0.796 . . . . 0.78000000000000003 112.606 178.24 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 26.9 t70 -81.59 -2.95 51.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.483 0.658 . . . . 1.8999999999999999 109.941 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 20.2 m -91.08 19.74 5.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.883 -0.599 . . . . 1.4399999999999999 111.045 -178.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.512 HG13 ' H ' ' B' 1017 ' ' ARG . 13.9 pt -82.54 -151.65 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.157 -0.474 . . . . 2.9100000000000001 110.601 176.373 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . 0.423 ' H ' ' HB ' ' B' 1015 ' ' ILE . 25.4 p-10 -62.89 -29.84 71.07 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.946 0.403 . . . . 4.29 110.518 175.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . 0.512 ' H ' HG13 ' B' 1015 ' ' ILE . 42.6 mtp180 -133.81 94.13 3.23 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.842 -0.617 . . . . 8.1699999999999999 110.402 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.626 0 CA-C-N 116.424 -0.353 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.91 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 53.8 mtm . . . . . 0 N--CA 1.484 1.233 0 CA-C-O 120.656 0.265 . . . . 6.21 110.853 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.1 m -85.81 108.21 18.0 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.811 -0.44 . . . . 1.8700000000000001 109.811 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.639 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 76.4 mm-40 -71.22 2.2 5.0 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 113.418 0.895 . . . . 2.4199999999999999 113.418 -171.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 31.0 p -68.68 -18.31 64.24 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.109 0.48 . . . . 1.25 110.626 177.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.762 ' HB2' HD13 ' A' ' 134' ' ' LEU . 13.2 p30 -68.88 -20.76 64.27 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.029 -0.532 . . . . 1.78 111.06 176.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.639 ' HB2' ' O ' ' A' ' 3' ' ' GLN . 0.1 OUTLIER -51.96 -51.77 54.88 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 115.801 -0.636 . . . . 1.3999999999999999 110.31 175.95 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.555 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 40.2 mt-10 -59.39 -48.2 82.56 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.867 -1.06 . . . . 0.68000000000000005 111.453 -176.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.668 HD22 ' HA ' ' A' ' 5' ' ' ASN . 1.4 mp -49.61 -34.55 18.28 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.439 -0.8 . . . . 1.1599999999999999 111.087 176.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.564 HG21 ' N ' ' A' ' 131' ' ' ALA . 72.6 t -79.39 -63.1 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.498 0.666 . . . . 0.27000000000000002 109.909 174.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 6' ' ' ARG . 93.6 t -50.66 -56.6 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 114.471 -1.241 . . . . 0.33000000000000002 112.766 -174.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.08 -33.08 68.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.709 0.29 . . . . 0.58999999999999997 110.469 -177.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 4.0 t80 -74.97 -46.2 37.03 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.287 -0.415 . . . . 1.6100000000000001 110.735 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.95 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.9 mp -62.72 -40.79 98.3 Favored 'General case' 0 N--CA 1.458 -0.068 0 C-N-CA 120.103 -0.639 . . . . 0.34000000000000002 110.202 178.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.8 t -61.17 -40.7 94.86 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.172 0.51 . . . . 1.05 110.065 176.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.431 ' HD2' ' HE3' ' A' ' 16' ' ' LYS . 81.3 t80 -63.15 -22.1 66.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.529 -0.759 . . . . 1.22 110.889 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.724 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.5 mmpt? -86.35 -43.75 12.62 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.516 0.674 . . . . 1.4099999999999999 110.203 -179.057 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.658 HD21 ' SG ' ' A' ' 111' ' ' CYS . 14.5 mt -66.69 -30.86 71.2 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 115.018 -0.992 . . . . 1.3500000000000001 110.69 178.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.0 t -56.31 -43.51 79.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.541 -0.754 . . . . 0.93999999999999995 111.564 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.406 ' HG3' ' O ' ' A' ' 16' ' ' LYS . 6.8 pt20 -80.22 0.97 30.22 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.073 0.463 . . . . 1.3700000000000001 112.103 -177.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.657 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 19.9 mmmt -108.28 -26.5 10.51 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 122.113 0.959 . . . . 2.2000000000000002 108.788 177.42 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.76 22.28 10.37 Favored Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 113.642 -1.617 . . . . 0.53000000000000003 111.47 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.713 ' HB3' ' HE2' ' A' ' 27' ' ' PHE . 89.9 m-85 -113.13 156.39 23.27 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.855 0.36 . . . . 0.76000000000000001 110.879 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 6.7 t -93.13 147.75 22.6 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.811 -0.631 . . . . 0.52000000000000002 110.688 -179.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -73.33 -53.01 11.84 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.794 -0.639 . . . . 3.3599999999999999 110.022 174.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 19.7 m -68.4 -28.89 67.49 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.186 0.439 . . . . 1.3700000000000001 112.186 -173.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -61.22 -29.63 69.94 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.672 -0.411 . . . . 1.1100000000000001 111.363 -179.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.713 ' HE2' ' HB3' ' A' ' 22' ' ' TYR . 13.5 m-85 -109.96 -15.34 14.09 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.3 -0.409 . . . . 1.28 111.338 -175.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.677 ' HB3' HG22 ' A' ' 30' ' ' VAL . 34.6 m -101.36 148.34 25.27 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 122.254 1.026 . . . . 1.8100000000000001 112.632 -176.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.29 -2.84 11.07 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 113.113 -1.858 . . . . 2.3100000000000001 109.149 -177.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.911 HG23 ' H ' ' A' ' 31' ' ' GLU . 5.2 m -64.66 -75.76 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 114.636 -1.166 . . . . 0.92000000000000004 113.141 -169.132 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.911 ' H ' HG23 ' A' ' 30' ' ' VAL . 10.2 mm-40 -85.24 -2.28 57.87 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 122.075 0.94 . . . . 2.7400000000000002 108.861 -179.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -64.67 -41.29 96.19 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 114.188 -1.369 . . . . 1.45 110.425 174.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.5 m-80 -106.0 -9.05 17.24 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.924 -0.58 . . . . 1.8700000000000001 112.198 -173.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.595 ' HG2' ' O ' ' A' ' 30' ' ' VAL . 19.3 ptp180 -128.71 155.93 44.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.017 0.437 . . . . 3.3900000000000001 111.245 -177.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.9 p -127.9 102.95 7.0 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.777 -0.647 . . . . 2.25 109.611 174.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.471 ' OE2' ' HD3' ' A' ' 34' ' ' ARG . 56.6 mt-10 -138.57 -69.24 0.44 Allowed 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.64 -0.709 . . . . 3.3399999999999999 111.05 -171.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.49 ' HB1' ' HG3' ' A' ' 7' ' ' GLU . . . -73.83 136.45 76.98 Favored Pre-proline 0 C--N 1.322 -0.615 0 C-N-CA 120.845 -0.342 . . . . 1.9199999999999999 110.9 177.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.853 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 26.2 Cg_exo -64.52 -175.03 0.31 Allowed 'Trans proline' 0 CA--C 1.53 0.299 0 C-N-CA 123.404 2.736 . . . . 1.8700000000000001 111.794 173.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -83.94 -8.53 59.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.524 0.678 . . . . 4.6399999999999997 109.836 176.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.416 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 159.44 71.55 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.874 0 CA-C-N 115.028 -0.987 . . . . 2.1499999999999999 111.318 -176.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.853 ' HB ' ' HG2' ' A' ' 38' ' ' PRO . 1.2 t -71.62 -75.27 0.13 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 120.538 -0.465 . . . . 1.1200000000000001 110.408 -175.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.812 ' H ' HG23 ' A' ' 41' ' ' THR . 17.0 pt-20 -94.7 -23.51 17.54 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 122.999 1.38 . . . . 2.02 108.291 165.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.843 ' HB2' ' HE3' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -63.04 -30.0 71.25 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 111.955 -2.384 . . . . 1.25 114.562 -169.725 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -46.19 -50.31 15.88 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 118.202 0.455 . . . . 1.9099999999999999 111.614 -173.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.604 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -74.93 -37.75 61.96 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.982 0.42 . . . . 0.52000000000000002 110.368 177.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.626 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 72.2 t -54.93 -65.21 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.37 -0.832 . . . . 1.4099999999999999 111.306 177.132 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.843 ' HE3' ' HB2' ' A' ' 43' ' ' SER . 19.3 ptpt -60.85 -34.51 74.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.865 -0.607 . . . . 0.67000000000000004 110.176 -176.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.654 HE21 ' ND2' ' A' ' 157' ' ' ASN . 6.8 mm100 -62.34 -36.36 81.97 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.64 -0.709 . . . . 0.98999999999999999 111.446 174.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.774 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -76.85 -35.25 57.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.497 0.665 . . . . 0.41999999999999998 110.066 175.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.577 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -54.85 -39.29 68.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.742 -1.117 . . . . 1.3300000000000001 112.118 -179.771 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.511 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 13.0 ptp180 -79.59 -33.53 41.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.588 0.709 . . . . 2.1699999999999999 109.426 -174.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.677 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 5.0 mm-40 -67.95 -43.67 78.52 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.582 -1.19 . . . . 1.1000000000000001 110.218 178.082 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.57 -41.49 72.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.495 -0.775 . . . . 0.53000000000000003 110.723 177.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.697 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.41 -44.62 97.36 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.825 -0.625 . . . . 0.69999999999999996 112.52 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.57 ' O ' HD22 ' A' ' 59' ' ' LEU . 28.8 t70 -54.33 -32.01 55.64 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.074 0.464 . . . . 1.04 111.294 -178.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -80.22 -25.6 39.54 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.379 -0.828 . . . . 2.29 112.488 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.633 ' CZ ' HD12 ' B' 1008 ' ' LEU . 91.7 t80 -82.54 -43.05 17.59 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.566 0.58 . . . . 2.29 112.566 -179.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.697 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 30.4 mt-10 -58.33 -48.03 81.85 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 113.494 0.924 . . . . 1.3 113.494 -168.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.62 ' H ' ' CD2' ' A' ' 59' ' ' LEU . 1.0 OUTLIER -78.74 -7.81 58.13 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 123.717 0.807 . . . . 1.54 112.409 -172.119 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 67.8 mtt-85 -45.01 -27.39 0.54 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 116.221 1.934 . . . . 2.5800000000000001 116.221 -161.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -90.38 -85.94 0.21 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 117.16 -1.816 . . . . 5.3200000000000003 109.894 174.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 56.6 mtm180 -109.18 -82.06 0.57 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 119.534 1.061 . . . . 4.4800000000000004 111.636 158.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.673 ' HB2' ' OD1' ' A' ' 67' ' ' ASP . 0.0 OUTLIER -103.07 11.65 36.93 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 113.844 -1.525 . . . . 4.7199999999999998 110.966 171.182 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.739 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -27.89 -54.99 0.1 Allowed 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 115.378 1.622 . . . . 1.1699999999999999 115.378 -150.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.453 ' CG ' ' HB3' ' A' ' 58' ' ' GLU . 19.6 p90 -47.82 -28.57 2.64 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 113.088 0.773 . . . . 2.8100000000000001 113.088 -176.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 50.7 m -90.69 -36.66 14.22 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.202 0.445 . . . . 2.1899999999999999 112.202 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.673 ' OD1' ' HB2' ' A' ' 63' ' ' ARG . 4.5 m-20 -83.01 -23.21 33.37 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 111.799 0.296 . . . . 2.7200000000000002 111.799 -174.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.739 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 32.2 mt -61.47 -15.55 38.61 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.717 1.006 . . . . 1.5600000000000001 113.717 -171.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.72 HG22 HG13 ' A' ' 74' ' ' ILE . 34.4 p -47.81 -29.27 3.06 Favored 'General case' 0 N--CA 1.465 0.296 0 O-C-N 123.314 0.384 . . . . 0.69999999999999996 111.482 -177.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.8 t -53.28 -59.38 4.64 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.752 -0.658 . . . . 1.3400000000000001 111.143 175.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.645 ' NE2' ' HA ' ' A' ' 68' ' ' LEU . 2.6 mp0 -54.51 -48.09 72.31 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.682 0.793 . . . . 1.4199999999999999 111.814 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.75 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.1 mp -81.25 -28.27 34.84 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.104 -0.953 . . . . 1.3700000000000001 111.922 -168.081 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 49.5 t-80 62.8 64.38 0.89 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 122.155 0.978 . . . . 2.7200000000000002 108.711 -177.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.72 HG13 HG22 ' A' ' 69' ' ' THR . 15.5 mm -65.03 118.54 7.54 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 113.963 -1.472 . . . . 0.91000000000000003 111.627 -174.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.729 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -151.26 -172.18 0.3 Allowed Pre-proline 0 CA--C 1.548 0.881 0 N-CA-C 107.47 -1.307 . . . . 0.51000000000000001 107.47 -171.247 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.729 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.3 Cg_exo -30.33 167.27 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 125.035 3.823 . . . . 0.46999999999999997 115.112 164.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.41 -25.68 0.0 OUTLIER Glycine 0 N--CA 1.475 1.239 0 N-CA-C 117.606 1.803 . . . . 0.40000000000000002 117.606 -174.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.473 ' N ' ' O ' ' A' ' 76' ' ' PRO . 34.6 p -72.05 6.76 1.95 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 118.119 0.959 . . . . 0.56000000000000005 111.514 177.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.46 -16.71 61.81 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 109.304 -0.628 . . . . 0.34000000000000002 109.304 169.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.543 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 66.2 t80 -76.06 -15.12 60.17 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.574 -0.739 . . . . 4.1299999999999999 109.186 174.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.501 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 78.1 mt-30 -82.85 -28.79 29.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.766 0.793 . . . . 1.03 109.487 172.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.75 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.5 m -72.05 -53.14 13.8 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.58 -1.191 . . . . 0.47999999999999998 109.687 173.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.511 ' HE1' ' HB3' ' A' ' 106' ' ' PHE . 78.8 t80 -65.13 -18.94 65.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.559 -0.746 . . . . 1.1799999999999999 110.345 175.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.64 ' HA ' HG12 ' A' ' 87' ' ' VAL . 42.6 tt0 -60.59 -46.91 88.48 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 115.724 -0.671 . . . . 0.80000000000000004 110.426 178.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -49.1 -34.6 14.25 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.749 -1.114 . . . . 1.6200000000000001 110.796 177.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.808 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.4 t -82.68 -54.72 8.84 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.025 -0.988 . . . . 1.3 110.867 -178.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.64 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.8 p -60.46 -25.31 33.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.537 0.684 . . . . 0.84999999999999998 109.648 -177.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.0 OUTLIER -62.08 -56.5 18.27 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.789 -1.096 . . . . 0.91000000000000003 110.742 171.607 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.917 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.0 OUTLIER -62.05 -36.36 81.4 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 108.428 -0.953 . . . . 2.8700000000000001 108.428 -175.738 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.782 HD23 ' HE ' ' A' ' 99' ' ' ARG . 27.3 mt -70.9 -24.28 62.44 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 113.672 -1.603 . . . . 1.28 112.345 -170.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.742 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 1.7 p90 -106.81 -23.56 12.35 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.052 0.453 . . . . 2.2999999999999998 111.516 -176.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.531 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 5.8 ptm180 -88.18 -41.56 12.9 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.889 0.376 . . . . 5.0599999999999996 111.71 -172.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -100.83 18.11 20.34 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.824 0.676 . . . . 3.1200000000000001 112.824 -165.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.528 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 129.03 69.38 0.12 Allowed Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 117.574 -2.25 . . . . 2.3100000000000001 114.846 178.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.742 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 61.1 t -70.7 103.94 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 118.421 1.111 . . . . 1.0600000000000001 110.416 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.656 ' N ' HD22 ' A' ' 96' ' ' ASN . 0.7 OUTLIER -110.93 -175.06 2.62 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.973 -1.012 . . . . 2.1200000000000001 108.427 176.562 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.535 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 21.8 m-90 -54.72 -47.33 73.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.008 0.432 . . . . 3.3399999999999999 110.27 178.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.692 ' HA3' ' HB ' ' B' 1015 ' ' ILE . . . -69.13 -30.47 71.9 Favored Glycine 0 CA--C 1.519 0.317 0 CA-C-N 115.738 -0.664 . . . . 0.68999999999999995 113.772 -176.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.782 ' HE ' HD23 ' A' ' 90' ' ' LEU . 9.9 mmm-85 -62.68 -35.61 80.23 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.4 0.619 . . . . 4.2400000000000002 110.798 -178.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.508 ' O ' ' HB3' ' A' ' 103' ' ' PHE . 72.5 mt -75.01 -41.25 45.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 CA-C-N 115.53 -0.759 . . . . 0.44 110.812 -177.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -59.53 -35.93 61.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 109.671 -0.492 . . . . 1.3500000000000001 109.671 174.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.16 87.27 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.786 -0.643 . . . . 0.44 110.632 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.535 ' HZ ' ' HA ' ' A' ' 130' ' ' MET . 67.4 t80 -51.9 -42.87 63.06 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.13 -0.941 . . . . 1.49 110.12 173.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.841 ' HZ ' HD12 ' A' ' 134' ' ' LEU . 89.0 m-85 -75.41 -39.7 58.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.076 -0.511 . . . . 3.29 111.367 178.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.49 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 19.3 m -56.16 -50.13 72.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.063 0.459 . . . . 1.1899999999999999 110.365 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.511 ' HB3' ' HE1' ' A' ' 83' ' ' PHE . 1.2 t80 -79.07 -35.42 42.47 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.95 -0.568 . . . . 2.8900000000000001 110.569 -178.226 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.673 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.06 -43.46 95.7 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.75 -0.738 . . . . 0.29999999999999999 111.999 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.95 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -67.64 -33.02 79.7 Favored Glycine 0 N--CA 1.443 -0.89 0 N-CA-C 110.875 -0.89 . . . . 0.23000000000000001 110.875 175.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.77 -34.25 73.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.47 -0.365 . . . . 0.31 110.606 176.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.538 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.47 -39.57 94.81 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 108.257 -1.016 . . . . 1.1200000000000001 108.257 -178.806 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.679 ' SG ' HG22 ' A' ' 123' ' ' VAL . 43.9 t -52.78 -52.6 56.04 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 113.899 -1.5 . . . . 0.26000000000000001 109.913 173.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.568 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 92.6 t -68.07 -38.43 79.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.97 -0.559 . . . . 0.34999999999999998 111.686 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.5 ' HB3' HG21 ' A' ' 74' ' ' ILE . 35.7 mt-10 -58.11 -28.17 64.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.158 0.504 . . . . 2.5099999999999998 110.027 176.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.46 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 50.8 m -79.01 -41.28 29.29 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.859 -0.61 . . . . 0.28000000000000003 109.503 176.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 111' ' ' CYS . 88.0 t -64.04 -33.92 65.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 122.066 0.936 . . . . 1.23 109.455 -179.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.454 ' OD1' ' HD3' ' A' ' 117' ' ' LYS . 15.2 t70 -51.54 -50.39 60.14 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 113.401 -1.727 . . . . 0.59999999999999998 111.278 178.186 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.454 ' HD3' ' OD1' ' A' ' 116' ' ' ASP . 12.1 mmtp -88.33 13.3 11.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.061 -0.518 . . . . 1.6200000000000001 110.231 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.446 ' HA ' HE21 ' A' ' 120' ' ' GLN . 44.4 mt-10 63.2 42.84 6.76 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-O 121.657 0.742 . . . . 1.8799999999999999 110.749 -177.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.46 ' CE ' ' HA ' ' A' ' 114' ' ' SER . 29.7 mtm -116.16 46.29 1.6 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.069 -1.086 . . . . 0.31 108.069 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.446 HE21 ' HA ' ' A' ' 118' ' ' GLU . 3.7 mt-30 -61.61 -7.45 3.35 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.468 -1.242 . . . . 1.1499999999999999 112.847 -175.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.562 HG23 HD22 ' A' ' 122' ' ' LEU . 27.8 m -65.82 -27.31 40.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 122.244 -0.285 . . . . 0.46000000000000002 111.067 173.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.693 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -70.8 -29.45 65.64 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 116.569 -0.287 . . . . 0.26000000000000001 110.321 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.679 HG22 ' SG ' ' A' ' 111' ' ' CYS . 76.3 t -43.05 -55.5 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 O-C-N 124.001 0.813 . . . . 0.25 111.909 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.579 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 2.9 t -70.32 -35.0 73.36 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.779 0.323 . . . . 1.3500000000000001 110.914 -178.103 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.693 ' HD2' HD13 ' A' ' 122' ' ' LEU . 94.7 mtt180 -63.47 -56.02 19.46 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 121.13 0.491 . . . . 2.6699999999999999 110.158 -178.243 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.538 HD13 ' HB3' ' A' ' 110' ' ' LEU . 68.8 mt -51.82 -53.72 16.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.139 -0.937 . . . . 0.23000000000000001 110.964 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.532 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -54.84 -34.45 62.87 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 111.711 0.263 . . . . 0.28999999999999998 111.711 -178.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.13 -58.05 8.53 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.48 0.657 . . . . 0.28000000000000003 110.892 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 67.3 m95 -68.76 -26.1 65.05 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.026 -0.988 . . . . 3.9100000000000001 111.224 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.673 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 21.5 mmm -62.87 -60.57 3.29 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.168 -0.469 . . . . 1.0800000000000001 110.683 176.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.564 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -62.37 -35.11 78.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.173 -0.467 . . . . 0.25 110.972 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 89.6 m -63.71 -47.47 80.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.336 -0.393 . . . . 0.40000000000000002 111.261 176.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.408 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 3.4 t80 -60.35 -37.35 80.4 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.96 -0.385 . . . . 3.1299999999999999 109.96 179.708 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.841 HD12 ' HZ ' ' A' ' 104' ' ' PHE . 5.9 tt -64.1 -50.2 69.21 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.752 -0.832 . . . . 0.94999999999999996 108.752 173.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -47.95 -57.37 5.82 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.878 -0.601 . . . . 0.46000000000000002 112.028 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -80.85 -48.85 11.82 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 112.398 0.518 . . . . 0.58999999999999997 112.398 -173.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . 0.408 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 0.3 OUTLIER -90.77 -47.81 7.41 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.127 0.788 . . . . 1.45 113.127 -169.007 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 58.2 mt -91.04 -32.89 15.73 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.011 0.745 . . . . 1.2 113.011 -165.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.629 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 29.6 tt0 -49.67 -50.23 68.07 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 111.915 0.339 . . . . 0.75 111.915 -174.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.613 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 13.3 Cg_endo -57.83 -49.7 12.36 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 121.902 1.735 . . . . 0.56000000000000005 111.913 175.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . 0.42 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -56.02 -47.41 77.85 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.721 -0.672 . . . . 1.2 110.471 179.282 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.545 HD12 ' HA ' ' A' ' 139' ' ' GLU . 15.0 mt -50.15 -50.86 19.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.609 -0.723 . . . . 0.32000000000000001 111.27 175.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.629 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 80.8 mm-40 -58.84 -34.09 71.18 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.572 -0.74 . . . . 0.56999999999999995 111.252 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.613 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 6.1 mm-40 -66.57 -21.71 66.14 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.381 0.61 . . . . 0.78000000000000003 110.773 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.634 ' N ' HD22 ' A' ' 145' ' ' ASN . 0.7 OUTLIER -102.42 -4.95 24.68 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.504 -0.771 . . . . 0.93000000000000005 109.787 -174.743 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 123.13 -31.92 4.54 Favored Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.479 -0.782 . . . . 0.56000000000000005 112.851 176.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.501 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 123.45 -175.48 16.71 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.731 -0.747 . . . . 0.48999999999999999 112.046 -178.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.475 ' NE1' HD13 ' A' ' 142' ' ' ILE . 11.2 m-90 -78.68 -39.69 36.01 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.839 0.352 . . . . 3.5699999999999998 110.38 -178.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -61.98 -42.21 98.88 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.109 -0.496 . . . . 1.96 110.07 179.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.607 ' O ' HD13 ' A' ' 154' ' ' LEU . 85.0 m -57.4 -35.5 70.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.768 -0.651 . . . . 0.67000000000000004 110.869 175.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.535 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 78.7 t80 -60.66 -39.84 89.85 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 120.43 -0.508 . . . . 3.0 110.102 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.604 HG21 ' HB1' ' A' ' 45' ' ' ALA . 1.3 m -78.18 -26.19 14.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.158 0.504 . . . . 1.1499999999999999 110.331 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -59.33 -42.32 91.19 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.399 0.619 . . . . 1.6699999999999999 109.695 171.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.607 HD13 ' O ' ' A' ' 150' ' ' THR . 8.1 mp -80.37 -60.04 2.47 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.093 -0.958 . . . . 1.3 112.873 177.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -119.86 27.04 8.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.272 0.558 . . . . 4.2400000000000002 110.203 -168.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.774 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -57.17 161.69 8.22 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-O 122.022 0.79 . . . . 1.1000000000000001 114.665 -178.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.677 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 28.1 t-20 -50.68 140.0 15.33 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 113.202 -1.499 . . . . 1.29 111.601 178.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.671 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 2.5 m120 -66.3 -29.18 69.33 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.427 0.528 . . . . 2.9900000000000002 112.427 -174.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.415 ' HB3' ' OD1' ' A' ' 157' ' ' ASN . . . -60.59 -28.34 68.41 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.112 0.482 . . . . 2.52 110.056 175.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -87.18 -34.53 18.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.972 -0.558 . . . . 2.8700000000000001 110.052 174.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.5 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -59.99 -51.6 68.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.917 -0.583 . . . . 3.2000000000000002 111.072 177.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.671 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 5.8 pt-20 -62.23 -27.75 69.21 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.664 0.268 . . . . 3.7200000000000002 111.399 175.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 12.5 t -70.5 -29.59 66.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.407 0.622 . . . . 4.1799999999999997 109.548 178.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 -79.07 -40.32 31.56 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.671 0.748 . . . . 5.8200000000000003 109.791 172.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -58.44 -42.25 86.93 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.622 -1.172 . . . . 4.7699999999999996 110.652 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -66.02 -40.69 95.32 Favored Glycine 0 N--CA 1.446 -0.659 0 CA-C-N 115.833 -0.621 . . . . 5.0999999999999996 112.873 -178.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -74.91 -30.19 61.2 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 117.163 0.482 . . . . 5.7199999999999998 110.375 -179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.779 ' HA ' ' HB2' ' A' ' 171' ' ' GLU . 47.8 mt-10 -82.72 10.49 7.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 5.8799999999999999 110.682 176.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.505 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 0.2 OUTLIER -79.91 -26.16 40.29 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.526 -0.916 . . . . 7.3399999999999999 108.526 174.778 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -90.63 -33.63 15.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.39 -0.823 . . . . 6.9699999999999998 109.377 171.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . 0.779 ' HB2' ' HA ' ' A' ' 168' ' ' GLU . 8.5 mm-40 -73.93 -175.73 2.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.055 -0.975 . . . . 6.9699999999999998 110.401 176.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -127.95 129.11 46.27 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.237 -0.438 . . . . 9.3499999999999996 109.838 173.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -65.8 114.88 5.38 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.458 0.647 . . . . 11.4 111.047 -175.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 45.4 p-80 -128.27 138.64 52.51 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.13 -0.941 . . . . 11.52 109.879 -177.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -79.58 10.92 3.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.322 -0.399 . . . . 14.48 111.688 -172.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 65.75 82.95 0.17 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.126 -0.488 . . . . 15.369999999999999 111.07 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 63.26 53.21 2.26 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.622 -0.717 . . . . 16.02 111.121 175.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 7.7 mp 63.64 -158.73 0.31 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.777 -0.647 . . . . 17.989999999999998 111.401 177.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -132.46 -28.42 1.66 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.191 -0.459 . . . . 19.190000000000001 110.633 177.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 -141.73 104.42 4.53 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.985 -0.552 . . . . 22.260000000000002 109.944 178.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 70.9 m80 -70.25 170.85 10.84 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.897 -0.592 . . . . 22.510000000000002 110.594 178.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -130.09 110.1 11.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.445 -0.343 . . . . 24.890000000000001 110.319 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -125.47 144.49 50.51 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.432 -0.349 . . . . 25.579999999999998 110.431 176.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -66.2 -42.12 89.25 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.985 -0.552 . . . . 27.370000000000001 111.431 -174.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 30.1 p-80 . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.297 -0.858 . . . . 29.059999999999999 110.353 -178.889 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.239 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -69.02 -31.11 72.13 Favored Glycine 0 N--CA 1.45 -0.425 0 N-CA-C 111.623 -0.591 . . . . 2.9700000000000002 111.623 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.682 ' HB3' ' O62' ' B' 1100 ' ' 33B . 22.4 m -110.65 -143.34 0.39 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.329 -0.619 . . . . 1.9399999999999999 109.329 175.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.92 HG23 ' H ' ' B' 1005 ' ' GLY . 32.2 m 43.39 -84.58 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 124.547 1.139 . . . . 1.6299999999999999 113.546 175.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 0.92 ' H ' HG23 ' B' 1004 ' ' VAL . . . -32.35 -38.01 0.05 OUTLIER Glycine 0 CA--C 1.53 1.013 0 CA-C-N 118.895 0.771 . . . . 1.2 113.014 160.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . 0.514 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 3.7 mpt_? -90.59 -41.74 11.18 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 120.776 0.322 . . . . 2.8799999999999999 111.241 175.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . 0.421 ' HA ' ' C7 ' ' B' 1100 ' ' 33B . . . -70.32 -66.13 0.64 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.466 0.543 . . . . 1.3100000000000001 112.466 -171.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.633 HD12 ' CZ ' ' A' ' 57' ' ' PHE . 3.3 mm? -57.5 -40.04 77.83 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.312 0.577 . . . . 1.3300000000000001 110.18 -173.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 0.917 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -53.92 -40.19 66.48 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.642 -1.163 . . . . 0.88 110.726 176.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.885 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -80.25 -41.22 25.48 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.827 -1.078 . . . . 1.03 111.143 -177.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.559 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 49.2 m-85 -70.52 -33.63 71.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.702 -0.681 . . . . 1.6699999999999999 111.581 -178.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -70.84 -24.42 77.05 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 121.188 -0.53 . . . . 0.78000000000000003 113.367 -175.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 38.5 t70 -74.19 -4.24 34.72 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.206 0.527 . . . . 1.8999999999999999 111.061 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 22.4 m -86.33 -13.79 45.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.011 0.434 . . . . 1.4399999999999999 110.202 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.692 ' HB ' ' HA3' ' A' ' 98' ' ' GLY . 27.5 mt -80.44 69.33 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.551 0.691 . . . . 2.9100000000000001 109.764 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 10.8 p30 -131.29 179.25 6.13 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.384 -0.825 . . . . 4.29 109.982 -179.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . 0.414 ' HD2' ' CG ' ' A' ' 154' ' ' LEU . 75.8 mtp180 -95.33 94.63 7.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.875 0.369 . . . . 8.1699999999999999 110.351 -179.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.607 0 CA-C-N 116.415 -0.357 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.885 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.7 ptp . . . . . 0 N--CA 1.483 1.21 0 CA-C-O 120.897 0.38 . . . . 6.21 110.707 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.516 ' HB3' ' OD1' ' A' ' 135' ' ' ASN . 49.4 m -81.54 12.21 3.96 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.141 -0.482 . . . . 1.8700000000000001 111.862 -177.185 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.646 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 26.8 mp0 -100.36 -22.53 15.04 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.61 -0.268 . . . . 2.4199999999999999 110.985 177.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.604 ' O ' HD13 ' A' ' 8' ' ' LEU . 19.3 m -72.45 -23.66 61.09 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 111.683 0.253 . . . . 1.25 111.683 -174.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.943 ' HA ' HD22 ' A' ' 8' ' ' LEU . 6.3 p30 -65.16 -22.43 66.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.763 0.316 . . . . 1.78 110.434 175.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.646 ' HB2' ' O ' ' A' ' 3' ' ' GLN . 0.6 OUTLIER -58.55 -53.15 61.59 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 115.949 -0.569 . . . . 1.3999999999999999 110.133 173.89 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -56.23 -49.11 75.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.184 -0.916 . . . . 0.68000000000000005 110.733 -178.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.943 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.6 OUTLIER -47.49 -44.19 25.2 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.499 -0.773 . . . . 1.1599999999999999 111.056 176.385 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.529 HG13 ' HE2' ' A' ' 130' ' ' MET . 72.9 t -70.79 -64.05 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.296 0.57 . . . . 0.27000000000000002 110.548 175.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.593 HG23 ' O ' ' A' ' 6' ' ' ARG . 48.8 t -51.83 -48.49 38.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 114.906 -1.043 . . . . 0.33000000000000002 112.676 -174.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -56.03 -38.06 70.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.291 -0.413 . . . . 0.58999999999999997 110.679 -178.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.646 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 47.6 t80 -74.33 -45.01 50.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.136 -0.483 . . . . 1.6100000000000001 110.964 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.726 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 5.8 mp -57.67 -44.06 85.49 Favored 'General case' 0 C--N 1.338 0.083 0 C-N-CA 120.386 -0.525 . . . . 0.34000000000000002 109.846 178.514 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 16.1 m -58.48 -40.47 82.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.47 0.652 . . . . 1.05 110.675 177.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -73.67 -17.99 61.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.299 -0.864 . . . . 1.22 111.215 -174.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.668 ' HA ' ' HE2' ' A' ' 16' ' ' LYS . 10.0 mmpt? -88.52 -47.75 8.09 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-O 121.5 0.667 . . . . 1.4099999999999999 110.32 -178.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.6 HD21 ' SG ' ' A' ' 111' ' ' CYS . 13.4 mt -57.41 -30.8 65.25 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 115.258 -0.883 . . . . 1.3500000000000001 111.335 177.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.5 t -57.24 -47.78 80.49 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.112 -0.495 . . . . 0.93999999999999995 111.409 177.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -74.14 1.4 11.29 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.931 0.396 . . . . 1.3700000000000001 111.854 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.627 ' HE2' HG11 ' A' ' 112' ' ' VAL . 15.3 mmmt -110.49 -26.74 9.34 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.953 0.883 . . . . 2.2000000000000002 109.172 178.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.72 26.3 7.23 Favored Glycine 0 N--CA 1.443 -0.833 0 CA-C-N 114.014 -1.448 . . . . 0.53000000000000003 111.921 178.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -122.59 167.19 13.7 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.851 0.358 . . . . 0.76000000000000001 110.831 174.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.9 t -110.55 151.19 27.9 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.897 -0.592 . . . . 0.52000000000000002 110.003 177.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -72.67 -51.1 20.85 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.08 -0.509 . . . . 3.3599999999999999 109.759 172.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.1 p -61.72 -40.61 95.69 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.68 -0.691 . . . . 1.3700000000000001 111.596 -171.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -55.74 -31.0 62.15 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.103 0.478 . . . . 1.1100000000000001 111.33 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.409 ' O ' ' HB2' ' A' ' 124' ' ' SER . 67.1 m-85 -114.14 16.05 18.15 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.937 -0.574 . . . . 1.28 111.125 -176.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.619 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 59.8 p -100.97 -179.68 4.12 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.739 0.781 . . . . 1.8100000000000001 112.359 -175.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.58 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 6.9 t70 -163.91 -24.44 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 113.934 -1.485 . . . . 2.3100000000000001 108.142 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.926 HG23 ' H ' ' A' ' 31' ' ' GLU . 9.9 m -57.91 -72.88 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 CA-C-N 113.884 -1.507 . . . . 0.92000000000000004 112.874 -177.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.926 ' H ' HG23 ' A' ' 30' ' ' VAL . 14.5 mm-40 -86.59 -0.05 55.4 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.543 -0.91 . . . . 2.7400000000000002 108.543 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.58 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.1 tt0 -73.3 -58.25 3.44 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.663 -1.153 . . . . 1.45 110.182 178.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.577 HD22 ' HG2' ' A' ' 32' ' ' GLU . 0.9 OUTLIER -81.85 -51.55 8.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.712 -0.676 . . . . 1.8700000000000001 110.827 -176.017 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.6 ptp180 -102.5 144.42 30.97 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.228 0.537 . . . . 3.3900000000000001 110.41 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 14.8 p -129.83 110.95 12.13 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.633 -0.712 . . . . 2.25 109.953 179.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -122.38 -67.33 0.96 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.714 -0.676 . . . . 3.3399999999999999 111.046 -173.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.444 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . . . -63.33 137.38 97.06 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 115.736 -0.665 . . . . 1.9199999999999999 111.491 179.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.735 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 50.6 Cg_exo -58.48 -178.09 0.11 Allowed 'Trans proline' 0 CA--C 1.529 0.227 0 C-N-CA 123.41 2.74 . . . . 1.8700000000000001 112.022 173.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -74.36 -11.38 60.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.22 0.533 . . . . 4.6399999999999997 110.361 178.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 160.54 70.97 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.883 0 N-CA-C 111.115 -0.794 . . . . 2.1499999999999999 111.115 178.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.821 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.5 t -71.9 -74.66 0.15 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 120.78 -0.368 . . . . 1.1200000000000001 110.586 -174.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.821 ' H ' HG23 ' A' ' 41' ' ' THR . 12.8 pt-20 -93.1 -29.99 15.49 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 122.545 1.164 . . . . 2.02 108.692 168.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.702 ' HA ' HG13 ' A' ' 46' ' ' VAL . 3.7 p -60.06 -27.13 66.71 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 112.717 -2.038 . . . . 1.25 113.599 -170.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -46.17 -54.15 9.2 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 111.8 0.296 . . . . 1.9099999999999999 111.8 -176.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.99 -41.76 61.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.555 0.217 . . . . 0.52000000000000002 111.521 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.702 HG13 ' HA ' ' A' ' 43' ' ' SER . 0.5 OUTLIER -70.19 -37.15 70.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.896 -0.322 . . . . 1.4099999999999999 111.29 -174.787 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.568 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 8.4 ptpt -68.12 -36.38 79.63 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.4 -0.963 . . . . 0.67000000000000004 108.4 176.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.498 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 3.8 mm100 -63.79 -38.84 92.61 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.195 -0.911 . . . . 0.98999999999999999 110.619 178.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.689 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -74.0 -41.38 61.97 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.183 0.516 . . . . 0.41999999999999998 110.632 176.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.45 HD22 ' HA ' ' A' ' 50' ' ' LEU . 0.1 OUTLIER -54.6 -43.53 72.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.092 -0.958 . . . . 1.3300000000000001 111.687 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.568 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 7.9 ptp180 -74.58 -26.16 59.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.179 0.514 . . . . 2.1699999999999999 110.026 -170.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.498 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 5.3 mm-40 -74.17 -51.46 15.44 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.898 -1.046 . . . . 1.1000000000000001 110.077 178.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.32 -42.13 99.13 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.517 -0.765 . . . . 0.53000000000000003 110.19 177.075 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.613 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -64.74 -38.29 95.43 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.584 -0.735 . . . . 0.69999999999999996 111.95 176.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.431 ' HA ' ' OE2' ' A' ' 58' ' ' GLU . 14.7 t70 -57.59 -54.14 50.2 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 122.337 0.255 . . . . 1.04 110.496 177.039 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.538 ' HA ' HD11 ' A' ' 59' ' ' LEU . 48.0 mt-10 -56.99 -27.72 61.72 Favored 'General case' 0 C--O 1.234 0.266 0 O-C-N 123.847 0.717 . . . . 2.29 111.569 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.452 ' CD1' HD11 ' B' 1015 ' ' ILE . 75.2 t80 -72.98 -30.67 63.98 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.929 -0.578 . . . . 2.29 110.921 177.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 41.0 mt-10 -70.47 -70.27 0.31 Allowed 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 112.18 0.437 . . . . 1.3 112.18 -173.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.674 HD22 ' N ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -55.6 -34.52 64.93 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.083 0.468 . . . . 1.54 111.457 -174.661 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.674 ' N ' HD22 ' A' ' 59' ' ' LEU . 7.3 ttm180 -53.04 -66.39 0.39 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.337 -0.847 . . . . 2.5800000000000001 111.676 176.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -94.22 -0.23 55.27 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.161 0.8 . . . . 5.3200000000000003 113.161 -172.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.479 ' HA ' ' CD2' ' A' ' 65' ' ' PHE . 3.0 tmt_? -43.69 -38.41 3.11 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.38 0.672 . . . . 4.4800000000000004 112.272 -176.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 67.1 mtt180 -46.39 -50.36 16.68 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 121.111 0.481 . . . . 4.7199999999999998 110.551 176.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.453 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -71.91 -47.76 50.34 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 115.609 -0.723 . . . . 1.1699999999999999 110.854 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.479 ' CD2' ' HA ' ' A' ' 62' ' ' ARG . 17.9 m-85 -45.9 -48.65 16.12 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.905 0.706 . . . . 2.8100000000000001 112.905 -172.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.412 ' HB2' ' NH1' ' A' ' 62' ' ' ARG . 27.8 t -62.46 -38.28 89.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.111 0.481 . . . . 2.1899999999999999 110.894 -177.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -81.21 -31.58 33.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.183 0.516 . . . . 2.7200000000000002 110.479 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 64' ' ' ALA . 1.8 mp -60.64 -17.66 48.65 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.309 -0.859 . . . . 1.5600000000000001 112.296 -177.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.73 HG22 HG13 ' A' ' 74' ' ' ILE . 3.4 p -55.83 -25.43 41.79 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.165 0.439 . . . . 0.69999999999999996 110.926 177.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.5 t -74.35 -37.24 63.56 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 121.266 0.555 . . . . 1.3400000000000001 109.535 175.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -72.36 -40.89 67.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.321 -0.854 . . . . 1.4199999999999999 110.37 -179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.432 ' O ' ' HB3' ' A' ' 73' ' ' HIS . 3.1 mm? -68.25 -34.31 75.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.641 -0.503 . . . . 1.3700000000000001 109.641 170.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.432 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 85.9 t60 71.11 0.76 3.54 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.586 -0.734 . . . . 2.7200000000000002 109.844 -171.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.73 HG13 HG22 ' A' ' 69' ' ' THR . 31.6 mm 20.12 -85.4 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 126.0 1.72 . . . . 0.91000000000000003 114.256 -179.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.891 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER 23.14 -160.87 0.0 OUTLIER Pre-proline 0 CA--C 1.588 2.423 0 C-N-CA 125.033 1.333 . . . . 0.51000000000000001 113.513 -173.927 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.891 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 76.2 Cg_exo -28.13 165.6 0.0 OUTLIER 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 125.267 3.978 . . . . 0.46999999999999997 117.281 169.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -34.68 -20.9 0.01 OUTLIER Glycine 0 C--N 1.347 1.153 0 N-CA-C 117.627 1.811 . . . . 0.40000000000000002 117.627 -173.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.438 ' N ' ' O ' ' A' ' 76' ' ' PRO . 38.2 p -66.69 0.91 2.04 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 117.97 0.885 . . . . 0.56000000000000005 111.481 178.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.512 ' HB2' ' O ' ' A' ' 74' ' ' ILE . . . -67.91 -14.72 63.19 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.987 -0.552 . . . . 0.34000000000000002 110.272 172.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -78.31 -21.01 50.29 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.367 -0.605 . . . . 4.1299999999999999 109.367 176.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.544 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 41.9 mt-30 -81.86 -25.87 34.71 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 122.006 0.908 . . . . 1.03 109.387 172.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.488 ' OG ' ' HA ' ' A' ' 79' ' ' ALA . 2.3 m -72.23 -54.22 10.26 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.344 -1.298 . . . . 0.47999999999999998 109.743 173.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.48 ' HE2' ' CE1' ' A' ' 103' ' ' PHE . 0.0 OUTLIER -62.41 -19.5 63.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 114.887 -1.051 . . . . 1.1799999999999999 110.213 176.21 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.602 ' HA ' HG12 ' A' ' 87' ' ' VAL . 37.2 tt0 -63.39 -51.6 65.17 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.043 -0.981 . . . . 0.80000000000000004 111.027 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -50.03 -33.05 16.94 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.076 -0.965 . . . . 1.6200000000000001 110.82 179.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.686 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -83.13 -51.65 14.19 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.04 0 CA-C-N 114.605 -1.179 . . . . 1.3 110.725 -177.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.602 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.8 p -61.64 -22.38 28.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.888 0.851 . . . . 0.84999999999999998 109.378 -178.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.577 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.7 m-80 -68.07 -51.72 43.35 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 114.142 -1.39 . . . . 0.91000000000000003 110.912 173.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.976 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.9 OUTLIER -65.45 -37.31 86.5 Favored 'General case' 0 CA--C 1.505 -0.778 0 CA-C-O 121.763 0.792 . . . . 2.8700000000000001 108.872 -178.932 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.624 ' HG ' ' CD ' ' A' ' 89' ' ' GLU . 21.1 mt -67.17 -19.22 65.55 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 113.907 -1.497 . . . . 1.28 112.591 -167.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.735 ' HA ' HG22 ' A' ' 95' ' ' VAL . 2.7 p90 -109.94 -19.7 13.01 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.78 -0.368 . . . . 2.2999999999999998 111.878 -174.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.577 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.0 OUTLIER -100.98 -22.53 14.74 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.255 -0.578 . . . . 5.0599999999999996 111.253 -177.984 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -96.15 21.19 9.18 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.822 -0.626 . . . . 3.1200000000000001 111.345 -169.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 112.82 67.62 0.51 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 118.291 -1.909 . . . . 2.3100000000000001 114.059 175.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.735 HG22 ' HA ' ' A' ' 91' ' ' PHE . 38.8 t -70.33 95.63 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.465 0 CA-C-O 122.67 1.224 . . . . 1.0600000000000001 110.928 -177.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.656 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 0.2 OUTLIER -110.2 179.21 4.16 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 113.095 -1.866 . . . . 2.1200000000000001 107.252 167.618 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.606 ' HB3' ' CD2' ' A' ' 151' ' ' PHE . 12.7 m-90 -51.87 -44.06 63.55 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 123.411 0.444 . . . . 3.3399999999999999 111.529 -176.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -62.71 -33.14 85.89 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 114.662 0.625 . . . . 0.68999999999999995 114.662 -176.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.656 ' HG2' ' ND2' ' A' ' 96' ' ' ASN . 81.5 mmt-85 -60.93 -38.72 86.79 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 117.632 0.716 . . . . 4.2400000000000002 110.38 -178.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.595 HG12 ' HG ' ' A' ' 138' ' ' LEU . 81.4 mt -75.17 -35.4 34.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 115.196 -0.911 . . . . 0.44 111.281 -173.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 1.4 m -65.88 -33.78 65.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.549 -0.537 . . . . 1.3500000000000001 109.549 173.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -66.51 -48.04 71.05 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.218 0.532 . . . . 0.44 109.603 175.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.48 ' CE1' ' HE2' ' A' ' 83' ' ' PHE . 42.8 t80 -50.48 -53.2 31.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.47 -1.241 . . . . 1.49 111.931 178.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.527 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 0.2 OUTLIER -80.08 -20.23 45.63 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.395 -0.522 . . . . 3.29 111.081 -175.027 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.646 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 31.3 t -75.01 -53.02 9.65 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.63 0.252 . . . . 1.1899999999999999 110.382 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.521 ' CZ ' ' HB ' ' A' ' 86' ' ' VAL . 2.3 p90 -68.23 -22.08 64.8 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 109.599 -0.519 . . . . 2.8900000000000001 109.599 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.464 ' HA2' ' HB2' ' A' ' 110' ' ' LEU . . . -75.07 -40.87 33.67 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.687 -0.768 . . . . 0.29999999999999999 111.507 174.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.726 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -64.57 -33.98 88.69 Favored Glycine 0 N--CA 1.448 -0.5 0 N-CA-C 110.916 -0.874 . . . . 0.23000000000000001 110.916 174.246 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.95 -29.23 58.22 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.532 -0.334 . . . . 0.31 110.449 173.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.464 ' HB2' ' HA2' ' A' ' 107' ' ' GLY . 0.2 OUTLIER -62.73 -39.67 94.79 Favored 'General case' 0 CA--C 1.509 -0.621 0 N-CA-C 107.758 -1.201 . . . . 1.1200000000000001 107.758 -179.915 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.727 ' SG ' HG22 ' A' ' 123' ' ' VAL . 41.1 t -48.69 -60.32 2.82 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-N 113.362 -1.744 . . . . 0.26000000000000001 109.554 171.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.924 ' HA ' HG13 ' A' ' 115' ' ' VAL . 46.0 t -66.38 -31.65 54.54 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 CA-C-N 116.366 -0.379 . . . . 0.34999999999999998 111.859 -178.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.533 ' O ' HG21 ' A' ' 74' ' ' ILE . 22.5 mt-10 -57.52 -20.72 33.42 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 118.28 0.491 . . . . 2.5099999999999998 110.321 176.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.519 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 50.1 m -89.54 -44.93 9.76 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 108.465 -0.939 . . . . 0.28000000000000003 108.465 179.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.924 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.4 m -67.86 -29.07 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.106 0 CA-C-N 115.061 -0.972 . . . . 1.23 109.623 -177.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -51.56 -50.62 59.73 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 113.379 -1.737 . . . . 0.59999999999999998 111.169 175.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt -86.15 13.57 7.65 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.695 -0.684 . . . . 1.6200000000000001 109.811 178.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.633 ' HA ' HE21 ' A' ' 120' ' ' GLN . 23.9 mm-40 63.57 53.54 2.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 122.016 0.912 . . . . 1.8799999999999999 110.571 -177.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.554 ' SD ' ' HA ' ' A' ' 75' ' ' THR . 27.1 mtm -132.27 39.83 3.37 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.197 -1.365 . . . . 0.31 107.457 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.661 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 3.9 mp0 -53.54 -6.82 0.08 Allowed 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 114.685 -1.143 . . . . 1.1499999999999999 113.18 -178.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.563 HG23 HD22 ' A' ' 122' ' ' LEU . 21.1 m -67.71 -29.01 43.74 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.588 -0.695 . . . . 0.46000000000000002 111.973 175.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.563 HD22 HG23 ' A' ' 121' ' ' VAL . 3.8 mm? -65.06 -27.27 68.67 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.02 0.438 . . . . 0.26000000000000001 110.294 178.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.727 HG22 ' SG ' ' A' ' 111' ' ' CYS . 39.8 t -44.13 -46.4 2.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 114.384 -1.28 . . . . 0.25 112.165 -177.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.619 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 23.0 t -73.83 -43.28 59.22 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.325 -0.398 . . . . 1.3500000000000001 111.743 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.452 ' HD3' HD12 ' A' ' 122' ' ' LEU . 8.6 ptm180 -72.24 -36.87 69.19 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 120.966 -0.293 . . . . 2.6699999999999999 110.264 -170.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.577 HD12 ' HA ' ' A' ' 111' ' ' CYS . 82.4 mt -55.45 -49.58 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.642 -0.254 . . . . 0.23000000000000001 111.323 174.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.563 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.2 -30.5 66.51 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.767 0.318 . . . . 0.28999999999999998 111.478 -178.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -62.09 -60.66 3.28 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.395 0.617 . . . . 0.28000000000000003 110.193 175.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.416 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 98.5 m95 -57.75 -41.8 82.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.648 -1.16 . . . . 3.9100000000000001 111.045 -178.071 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.529 ' HE2' HG13 ' A' ' 9' ' ' VAL . 87.5 mtp -59.11 -57.74 11.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.457 -0.338 . . . . 1.0800000000000001 111.416 -178.247 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.1 74.87 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.872 -0.331 . . . . 0.25 110.87 -177.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.421 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 22.4 m -68.02 -45.18 74.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.852 0.358 . . . . 0.40000000000000002 111.458 176.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.61 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 13.0 m-85 -63.78 -33.29 75.33 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.896 -0.321 . . . . 3.1299999999999999 110.422 177.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.819 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.7 tt -64.43 -50.95 65.58 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 108.354 -0.98 . . . . 0.94999999999999996 108.354 170.079 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . 0.516 ' OD1' ' HB3' ' A' ' 2' ' ' SER . 2.3 m-80 -49.02 -60.83 2.44 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.651 0.611 . . . . 0.46000000000000002 112.651 -179.366 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -78.51 -44.91 23.22 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.931 0.396 . . . . 0.58999999999999997 111.941 -172.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . 0.61 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 14.5 m80 -90.54 -51.41 5.41 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.857 0.688 . . . . 1.45 112.857 -170.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.819 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -85.37 -47.07 10.35 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 113.932 1.086 . . . . 1.2 113.932 -168.844 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.694 ' HA ' HD12 ' A' ' 142' ' ' ILE . 37.7 tt0 -45.48 -52.72 21.56 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 112.891 0.7 . . . . 0.75 112.891 -173.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.596 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 51.5 Cg_exo -53.44 -48.97 19.08 Favored 'Trans proline' 0 C--N 1.357 1.013 0 C-N-CA 121.717 1.612 . . . . 0.56000000000000005 111.522 177.023 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -61.26 -46.1 91.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.332 -0.849 . . . . 1.2 110.339 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.694 HD12 ' HA ' ' A' ' 139' ' ' GLU . 37.5 mt -48.46 -51.25 11.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.073 0.464 . . . . 0.32000000000000001 111.117 175.264 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.595 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 74.7 mm-40 -59.14 -32.92 70.3 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.453 -0.794 . . . . 0.56999999999999995 111.485 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 12.3 mm-40 -64.59 -21.13 66.62 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.585 0.707 . . . . 0.78000000000000003 110.871 177.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -106.76 11.86 29.75 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.0 -1.0 . . . . 0.93000000000000005 109.54 -175.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 113.62 -35.02 4.73 Favored Glycine 0 N--CA 1.439 -1.122 0 CA-C-N 114.525 -1.216 . . . . 0.56000000000000005 112.895 174.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 124.46 -170.86 16.57 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.664 -0.779 . . . . 0.48999999999999999 111.691 -177.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.542 ' NE1' HD13 ' A' ' 142' ' ' ILE . 4.4 m-90 -78.54 -33.46 47.84 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.565 0.221 . . . . 3.5699999999999998 111.099 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -65.28 -41.71 93.88 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.922 0.391 . . . . 1.96 110.309 178.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.462 ' O ' ' HB2' ' A' ' 153' ' ' GLU . 88.2 m -56.94 -35.85 69.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.868 -0.605 . . . . 0.67000000000000004 111.197 177.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.606 ' CD2' ' HB3' ' A' ' 97' ' ' TRP . 53.5 t80 -58.92 -41.97 88.58 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.216 -0.447 . . . . 3.0 110.552 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.522 HG12 ' HA ' ' A' ' 46' ' ' VAL . 2.0 m -72.81 -25.75 22.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.098 0.475 . . . . 1.1499999999999999 110.304 -179.039 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 150' ' ' THR . 62.0 mm-40 -60.81 -23.21 64.88 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.033 0.444 . . . . 1.6699999999999999 110.551 173.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.525 ' HB2' ' CD1' ' A' ' 155' ' ' TYR . 0.5 OUTLIER -105.5 -54.27 2.51 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.887 -0.597 . . . . 1.3 110.956 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . 0.525 ' CD1' ' HB2' ' A' ' 154' ' ' LEU . 88.8 m-85 -110.61 14.51 22.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.643 -0.708 . . . . 4.2400000000000002 111.242 -171.153 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.689 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -59.76 158.93 23.2 Favored Glycine 0 CA--C 1.504 -0.643 0 C-N-CA 121.251 -0.5 . . . . 1.1000000000000001 113.629 -175.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -48.73 108.87 0.2 Allowed 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 113.94 -1.13 . . . . 1.29 110.947 178.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.692 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 3.9 m120 -76.26 -26.49 56.01 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.382 -0.372 . . . . 2.9900000000000002 111.912 -174.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -55.08 -48.15 73.92 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.895 0.378 . . . . 2.52 110.743 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -75.0 -37.01 61.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.099 -0.5 . . . . 2.8700000000000001 110.788 176.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.527 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -58.25 -56.2 25.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.969 -0.56 . . . . 3.2000000000000002 111.596 -178.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.692 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 10.6 pt-20 -66.22 -25.22 66.81 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.53 0.205 . . . . 3.7200000000000002 111.218 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 16.4 t -68.37 -47.31 67.72 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 109.605 -0.517 . . . . 4.1799999999999997 109.605 -179.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . 0.413 ' HD2' ' HA ' ' A' ' 164' ' ' ARG . 0.8 OUTLIER -77.86 -17.74 57.01 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.501 0.667 . . . . 5.8200000000000003 110.276 177.79 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.506 ' HB3' ' HA ' ' A' ' 162' ' ' GLU . 41.3 ttmt -76.87 -37.78 54.92 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.209 -0.905 . . . . 4.7699999999999996 109.796 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -62.71 -39.19 97.63 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.317 -0.856 . . . . 5.0999999999999996 112.617 -178.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -74.63 -23.19 58.65 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 122.496 -0.414 . . . . 5.7199999999999998 110.387 178.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -74.23 -13.98 60.86 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.766 -0.652 . . . . 5.8799999999999999 109.362 175.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.524 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 4.2 tmt_? -92.05 -29.3 16.65 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.201 -0.909 . . . . 7.3399999999999999 108.686 178.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.444 HD22 ' HA ' ' A' ' 170' ' ' LEU . 0.3 OUTLIER -87.83 -59.54 2.22 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.442 -0.799 . . . . 6.9699999999999998 109.401 -174.53 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -83.04 124.27 30.27 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.081 -0.711 . . . . 6.9699999999999998 109.081 176.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -96.32 117.75 31.46 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.861 0.362 . . . . 9.3499999999999996 110.301 -178.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -75.43 -5.67 46.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.833 -0.621 . . . . 11.4 112.062 -174.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -75.88 96.42 3.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.898 0.38 . . . . 11.52 110.399 177.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -101.47 -41.44 6.63 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.285 -0.635 . . . . 14.48 109.285 175.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 82.2 t60 -170.16 -77.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.504 -0.771 . . . . 15.369999999999999 109.769 175.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . 0.449 ' HB3' HD23 ' A' ' 178' ' ' LEU . 26.5 m170 45.1 -100.96 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.456 0 O-C-N 123.692 0.62 . . . . 16.02 112.218 -177.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.451 HD23 ' H ' ' A' ' 178' ' ' LEU . 2.5 pt? -137.28 152.32 49.66 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.963 -0.384 . . . . 17.989999999999998 109.963 -179.066 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -110.72 153.93 24.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.0 -0.545 . . . . 19.190000000000001 110.656 -177.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -80.58 150.68 29.45 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.551 -0.537 . . . . 22.260000000000002 109.551 178.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -87.87 122.06 31.04 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.042 0.448 . . . . 22.510000000000002 110.864 -178.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 42.4 t-80 -96.56 -12.1 24.49 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.646 -0.707 . . . . 24.890000000000001 109.585 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -80.03 126.79 31.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.718 -0.674 . . . . 25.579999999999998 109.746 174.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 21.9 t60 -91.72 -20.58 21.41 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.047 0.451 . . . . 27.370000000000001 109.922 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 40.7 m80 . . . . . 0 C--O 1.247 0.946 0 CA-C-O 118.455 -0.783 . . . . 29.059999999999999 110.015 179.132 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.291 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . 72.68 54.05 7.79 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.873 -0.679 . . . . 2.9700000000000002 111.545 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.467 ' HA ' ' HB2' ' B' 1006 ' ' ARG . 25.4 m -125.9 -149.52 0.42 Allowed 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 110.379 -0.23 . . . . 1.9399999999999999 110.379 -177.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.96 HG23 ' H ' ' B' 1005 ' ' GLY . 14.8 m 52.63 -92.87 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 124.548 1.139 . . . . 1.6299999999999999 112.571 174.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 0.96 ' H ' HG23 ' B' 1004 ' ' VAL . . . -46.23 -25.39 1.87 Allowed Glycine 0 CA--C 1.532 1.14 0 CA-C-N 119.914 1.234 . . . . 1.2 113.037 165.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . 0.467 ' HB2' ' HA ' ' B' 1003 ' ' CYS . 10.3 mpt_? -85.32 -47.8 9.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.103 0.478 . . . . 2.8799999999999999 111.165 171.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . 0.645 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -82.68 -52.74 6.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.829 -0.623 . . . . 1.3100000000000001 112.543 -168.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.646 HD23 ' HA ' ' B' 1004 ' ' VAL . 3.9 mm? -59.58 -58.56 8.04 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 123.172 0.295 . . . . 1.3300000000000001 110.542 -176.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 0.976 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -32.35 -53.63 0.31 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 122.186 0.993 . . . . 0.88 112.059 170.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.832 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -68.69 -55.19 12.23 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 113.816 -1.538 . . . . 1.03 111.877 -176.199 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.605 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 48.9 m-85 -64.7 -23.27 67.2 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.199 -0.455 . . . . 1.6699999999999999 111.048 -178.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . 0.465 ' O ' HD13 ' B' 1015 ' ' ILE . . . -72.19 -6.66 65.39 Favored Glycine 0 N--CA 1.446 -0.669 0 CA-C-N 116.006 -0.543 . . . . 0.78000000000000003 112.831 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 31.5 t70 -80.87 -2.26 46.69 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 111.757 0.28 . . . . 1.8999999999999999 111.757 177.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 2.4 m -112.32 24.11 12.91 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 121.793 -0.567 . . . . 1.4399999999999999 111.419 -174.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.465 HD13 ' O ' ' B' 1012 ' ' GLY . 1.7 mp -76.26 104.56 4.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.925 0.393 . . . . 2.9100000000000001 111.243 -178.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . 0.413 ' HB3' ' HE2' ' A' ' 155' ' ' TYR . 24.3 t-20 57.64 88.19 0.06 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.224 -0.898 . . . . 4.29 112.086 172.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -153.06 -78.29 0.11 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.034 -0.53 . . . . 8.1699999999999999 110.419 179.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 116.611 -0.268 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.832 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.5 ttp . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 120.963 0.411 . . . . 6.21 110.039 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.8 m -99.61 113.0 25.15 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.241 0.543 . . . . 1.8700000000000001 110.596 179.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.63 ' O ' ' HB2' ' A' ' 6' ' ' ARG . 43.7 tp60 -71.84 -7.18 46.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.264 0.554 . . . . 2.4199999999999999 109.69 178.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.793 ' HB3' ' HB3' ' A' ' 38' ' ' PRO . 63.5 p -76.33 -16.21 59.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.805 -0.634 . . . . 1.25 110.249 177.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.814 ' HB3' HD13 ' A' ' 134' ' ' LEU . 51.5 m-20 -66.81 -19.82 65.82 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.462 -0.57 . . . . 1.78 109.462 175.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.63 ' HB2' ' O ' ' A' ' 3' ' ' GLN . 2.5 mmt85 -51.01 -51.02 57.22 Favored 'General case' 0 CA--C 1.509 -0.607 0 CA-C-N 115.417 -0.811 . . . . 1.3999999999999999 110.522 176.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.438 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 43.5 mt-10 -56.38 -47.2 79.42 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.172 -0.922 . . . . 0.68000000000000005 111.163 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.764 HD22 ' HA ' ' A' ' 5' ' ' ASN . 1.2 mp -51.44 -31.58 23.67 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.508 -0.769 . . . . 1.1599999999999999 111.21 176.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.454 HG21 ' CA ' ' A' ' 131' ' ' ALA . 77.9 t -83.1 -67.05 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.55 0.691 . . . . 0.27000000000000002 110.531 172.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 6' ' ' ARG . 51.1 t -50.28 -55.26 6.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.656 -1.156 . . . . 0.33000000000000002 113.515 -172.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -50.73 -33.33 22.55 Favored 'General case' 0 C--O 1.234 0.246 0 O-C-N 123.635 0.584 . . . . 0.58999999999999997 111.364 -174.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.651 ' HE1' ' HB3' ' A' ' 51' ' ' ARG . 98.9 m-85 -90.37 -35.57 15.12 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.838 -0.619 . . . . 1.6100000000000001 112.37 -175.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 1.053 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 2.6 mp -60.12 -37.57 80.41 Favored 'General case' 0 CA--C 1.519 -0.221 0 C-N-CA 119.368 -0.933 . . . . 0.34000000000000002 108.93 174.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.452 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 39.8 t -58.75 -44.98 90.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.278 -0.873 . . . . 1.05 110.68 175.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -66.9 -33.92 76.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.072 -0.513 . . . . 1.22 110.702 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.63 ' HG2' ' O ' ' A' ' 12' ' ' PHE . 8.5 mmpt? -68.97 -33.24 73.37 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.434 -0.348 . . . . 1.4099999999999999 110.962 -178.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.628 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -73.2 -30.02 63.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.876 0.37 . . . . 1.3500000000000001 110.434 176.447 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.6 t -62.44 -36.15 81.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.911 -0.586 . . . . 0.93999999999999995 111.4 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -77.07 -1.91 31.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.132 0.491 . . . . 1.3700000000000001 111.664 -179.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.594 ' HE2' HG11 ' A' ' 112' ' ' VAL . 15.6 mmmt -111.75 -26.21 9.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.872 0.844 . . . . 2.2000000000000002 109.227 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.69 23.14 8.96 Favored Glycine 0 N--CA 1.441 -0.982 0 CA-C-N 113.978 -1.465 . . . . 0.53000000000000003 111.719 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.484 ' HE2' HE21 ' A' ' 120' ' ' GLN . 50.0 m-85 -113.66 164.69 13.36 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 110.023 -0.362 . . . . 0.76000000000000001 110.023 175.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.607 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 2.1 t -111.57 143.68 42.06 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.975 -0.557 . . . . 0.52000000000000002 109.833 176.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.452 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 0.8 OUTLIER -66.5 -48.75 68.82 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.229 -0.441 . . . . 3.3599999999999999 110.117 174.631 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.484 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 3.9 p -64.36 -27.84 69.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.101 -0.5 . . . . 1.3700000000000001 111.919 -174.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.607 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 94.7 mt-30 -57.36 -33.65 68.01 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.203 0.525 . . . . 1.1100000000000001 110.989 176.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.411 ' O ' ' HB2' ' A' ' 124' ' ' SER . 62.3 m-85 -120.09 14.86 12.34 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.604 -0.726 . . . . 1.28 111.319 -170.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.579 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 72.5 p -100.98 179.89 4.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 122.074 0.94 . . . . 1.8100000000000001 112.94 -172.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.598 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 21.4 t70 -168.69 -20.28 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 113.182 -1.827 . . . . 2.3100000000000001 107.933 179.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.884 HG23 ' H ' ' A' ' 31' ' ' GLU . 5.8 m -57.51 -71.8 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 114.171 -1.377 . . . . 0.92000000000000004 112.669 -176.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.884 ' H ' HG23 ' A' ' 30' ' ' VAL . 24.2 mm-40 -87.82 -2.92 58.92 Favored 'General case' 0 CA--C 1.511 -0.537 0 N-CA-C 108.668 -0.864 . . . . 2.7400000000000002 108.668 177.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.598 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 34.6 tt0 -76.27 -41.18 49.71 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.6 -1.182 . . . . 1.45 109.378 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.46 ' ND2' ' HG2' ' A' ' 32' ' ' GLU . 34.4 m-80 -135.8 90.21 2.57 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.218 -0.901 . . . . 1.8700000000000001 109.341 177.347 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.543 ' HB3' ' O ' ' A' ' 30' ' ' VAL . 10.2 ptm180 -147.24 -174.87 4.63 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-O 121.753 0.787 . . . . 3.3900000000000001 112.526 -175.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.1 p -67.54 -179.91 1.19 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.045 -1.434 . . . . 2.25 112.187 174.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.502 ' HG3' ' H ' ' A' ' 37' ' ' ALA . 6.0 pt-20 -77.03 -111.57 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 114.212 -1.358 . . . . 3.3399999999999999 112.343 -178.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.502 ' H ' ' HG3' ' A' ' 36' ' ' GLU . . . -97.99 150.04 36.34 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-N 114.996 -1.002 . . . . 1.9199999999999999 112.283 -172.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.793 ' HB3' ' HB3' ' A' ' 4' ' ' SER . 24.1 Cg_exo -64.15 159.55 42.53 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 123.455 2.77 . . . . 1.8700000000000001 112.299 171.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -87.45 6.56 33.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.782 0.801 . . . . 4.6399999999999997 109.833 173.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.562 ' O ' ' HG2' ' A' ' 42' ' ' GLU . . . -173.63 71.84 0.1 OUTLIER Glycine 0 N--CA 1.445 -0.749 0 CA-C-N 114.885 -1.052 . . . . 2.1499999999999999 110.582 -176.025 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.638 HG22 ' HB2' ' A' ' 38' ' ' PRO . 1.5 p -72.79 13.91 0.33 Allowed 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 123.959 0.904 . . . . 1.1200000000000001 113.19 -172.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.562 ' HG2' ' O ' ' A' ' 40' ' ' GLY . 10.4 pt-20 -29.3 -32.55 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.713 1.205 . . . . 2.02 113.454 169.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.724 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 2.7 p -30.74 -49.03 0.12 Allowed 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 114.228 1.196 . . . . 1.25 114.228 -177.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -40.27 -50.93 2.76 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.748 0.648 . . . . 1.9099999999999999 112.748 -173.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -76.39 -36.38 58.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.697 0.284 . . . . 0.52000000000000002 111.519 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.577 ' HA ' HG12 ' A' ' 152' ' ' VAL . 1.0 OUTLIER -74.25 -39.05 49.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.632 -0.258 . . . . 1.4099999999999999 111.344 -175.011 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.724 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.0 ptpt -67.37 -44.43 78.97 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 108.993 -0.743 . . . . 0.67000000000000004 108.993 174.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.451 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 3.6 mm100 -54.12 -35.18 61.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.724 -0.671 . . . . 0.98999999999999999 112.038 174.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.627 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -80.66 -30.94 36.52 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.105 0.479 . . . . 0.41999999999999998 111.036 177.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.612 ' HG ' ' CE2' ' A' ' 104' ' ' PHE . 1.1 mp -68.34 -26.92 65.84 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.707 -0.679 . . . . 1.3300000000000001 111.744 -176.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.651 ' HB3' ' HE1' ' A' ' 12' ' ' PHE . 5.3 ptp180 -80.83 -26.6 36.95 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 121.57 0.7 . . . . 2.1699999999999999 109.26 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -71.5 -54.33 10.92 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.592 -1.186 . . . . 1.1000000000000001 109.707 177.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.36 -39.31 93.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.724 -0.671 . . . . 0.53000000000000003 110.454 176.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.701 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -58.22 -51.92 55.66 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.666 -0.697 . . . . 0.69999999999999996 112.003 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.552 ' O ' HD22 ' A' ' 59' ' ' LEU . 17.8 t70 -53.33 -40.89 65.2 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.956 0.408 . . . . 1.04 111.226 -179.516 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.523 ' O ' HD21 ' A' ' 59' ' ' LEU . 44.2 mt-10 -75.27 -25.34 57.93 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.453 -0.794 . . . . 2.29 111.645 -179.018 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.902 ' HZ ' ' HA2' ' B' 1012 ' ' GLY . 8.0 t80 -85.38 -46.95 10.46 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.74 0.644 . . . . 2.29 112.74 178.456 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.701 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 44.8 mt-10 -54.86 -52.12 63.81 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 112.737 0.643 . . . . 1.3 112.737 -166.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.581 ' N ' HD23 ' A' ' 59' ' ' LEU . 2.2 pt? -52.15 -34.25 43.94 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.196 -0.911 . . . . 1.54 111.697 -174.327 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 20.6 mtp180 -55.35 -55.15 34.81 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.466 -0.334 . . . . 2.5800000000000001 111.154 -178.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.613 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 47.4 p90 -93.03 -3.58 54.09 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.242 -0.435 . . . . 5.3200000000000003 111.775 -178.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.632 ' HA ' ' CD1' ' A' ' 65' ' ' PHE . 41.6 ttm180 -50.87 -36.04 35.78 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.746 0.647 . . . . 4.4800000000000004 112.746 -173.113 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -61.81 -31.59 71.83 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.605 0.24 . . . . 4.7199999999999998 111.512 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.638 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -90.06 -47.8 7.6 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.567 0.58 . . . . 1.1699999999999999 112.567 -174.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.632 ' CD1' ' HA ' ' A' ' 62' ' ' ARG . 5.7 p90 -58.47 -27.09 64.09 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.703 0.631 . . . . 2.8100000000000001 112.703 -166.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 17.0 t -70.58 -31.59 68.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.151 0.5 . . . . 2.1899999999999999 110.259 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -91.01 -24.96 19.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 2.7200000000000002 111.008 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 59.9 mt -59.76 -16.69 29.54 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.915 0.709 . . . . 1.5600000000000001 112.915 -174.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.658 HG22 HG13 ' A' ' 74' ' ' ILE . 16.6 p -50.91 -35.89 35.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.113 0.482 . . . . 0.69999999999999996 111.113 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 13.4 t -67.01 -34.72 78.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.402 -0.817 . . . . 1.3400000000000001 110.755 178.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.494 HE22 ' HB2' ' B' 1003 ' ' CYS . 7.9 mt-30 -78.54 -49.06 13.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.776 -0.647 . . . . 1.4199999999999999 110.289 -177.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.723 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.1 mt -67.06 -30.64 70.76 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.397 -0.819 . . . . 1.3700000000000001 110.196 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.1 m80 68.58 61.31 0.36 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.922 0.868 . . . . 2.7200000000000002 109.191 -177.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.658 HG13 HG22 ' A' ' 69' ' ' THR . 16.0 mm -64.93 123.54 17.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 114.009 -1.45 . . . . 0.91000000000000003 110.926 -178.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.773 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.1 -169.35 0.22 Allowed Pre-proline 0 CA--C 1.547 0.863 0 N-CA-C 107.515 -1.291 . . . . 0.51000000000000001 107.515 -169.872 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.773 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.5 Cg_exo -30.5 166.26 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.272 0 C-N-CA 124.722 3.614 . . . . 0.46999999999999997 114.875 164.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.24 -28.93 0.01 OUTLIER Glycine 0 N--CA 1.476 1.331 0 N-CA-C 117.089 1.596 . . . . 0.40000000000000002 117.089 -175.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.455 ' N ' ' O ' ' A' ' 76' ' ' PRO . 22.1 p -69.27 6.53 0.97 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 117.693 0.747 . . . . 0.56000000000000005 111.695 178.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.3 -14.23 62.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.391 -0.596 . . . . 0.34000000000000002 109.391 169.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -75.48 -16.81 60.27 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 115.649 -0.705 . . . . 4.1299999999999999 109.348 174.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.491 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 76.5 mt-30 -83.8 -27.01 29.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.947 0.879 . . . . 1.03 109.635 173.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.723 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 4.8 m -72.1 -52.45 16.74 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.646 -1.161 . . . . 0.47999999999999998 109.187 171.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.438 ' HB2' ' HG ' ' A' ' 110' ' ' LEU . 75.6 t80 -65.03 -16.1 63.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.887 -1.051 . . . . 1.1799999999999999 110.005 174.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.65 ' HA ' HG12 ' A' ' 87' ' ' VAL . 34.1 tt0 -62.95 -50.14 71.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.975 0.416 . . . . 0.80000000000000004 110.288 176.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -44.32 -45.55 8.8 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-N 114.793 -1.094 . . . . 1.6200000000000001 111.343 179.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.637 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.4 p -90.44 -39.21 11.79 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.485 0 CA-C-N 113.42 -1.718 . . . . 1.3 111.77 -171.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.65 HG12 ' HA ' ' A' ' 84' ' ' GLU . 5.3 p -64.86 -23.4 33.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.894 0.854 . . . . 0.84999999999999998 109.063 176.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 1.1 m-80 -70.49 -46.09 64.4 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.309 -1.314 . . . . 0.91000000000000003 111.345 175.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 1.029 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.7 OUTLIER -69.14 -36.4 77.41 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 108.59 -0.893 . . . . 2.8700000000000001 108.59 -179.222 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.633 HD12 ' HD2' ' A' ' 99' ' ' ARG . 1.1 tp -69.58 -20.16 63.65 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-N 113.797 -1.547 . . . . 1.28 111.783 -168.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.6 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 2.5 p90 -110.66 -12.3 14.34 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.441 -0.503 . . . . 2.2999999999999998 111.569 -175.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.57 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 9.0 ptm180 -98.46 -35.47 10.25 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.388 0.613 . . . . 5.0599999999999996 110.988 -179.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -82.93 5.05 23.24 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.323 -0.853 . . . . 3.1200000000000001 112.587 -167.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 131.26 67.49 0.1 OUTLIER Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 117.83 -2.129 . . . . 2.3100000000000001 114.724 -177.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.6 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 57.3 t -72.71 95.86 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 122.056 0.931 . . . . 1.0600000000000001 111.307 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -113.19 -171.0 1.79 Allowed 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.425 -1.261 . . . . 2.1200000000000001 108.868 173.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.615 ' HB3' ' HE2' ' A' ' 155' ' ' TYR . 15.7 m-90 -53.39 -54.23 39.77 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 123.475 0.484 . . . . 3.3399999999999999 111.345 -179.544 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.758 ' HA3' HG21 ' B' 1015 ' ' ILE . . . -77.17 -16.59 80.47 Favored Glycine 0 CA--C 1.52 0.381 0 C-N-CA 121.093 -0.575 . . . . 0.68999999999999995 113.775 -175.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.649 HH12 ' HA ' ' B' 1009 ' ' ALA . 7.5 tpp180 -67.36 -43.02 82.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.066 0.46 . . . . 4.2400000000000002 110.464 -178.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.421 ' CD1' ' HG ' ' A' ' 138' ' ' LEU . 85.5 mt -69.86 -31.78 49.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 121.3 0.572 . . . . 0.44 110.488 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.619 ' HA ' ' CD2' ' A' ' 104' ' ' PHE . 59.8 t -52.96 -51.72 35.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.35 -0.841 . . . . 1.3500000000000001 110.352 172.42 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.406 ' HB2' ' CE1' ' A' ' 57' ' ' PHE . . . -55.31 -47.61 75.36 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.657 -0.701 . . . . 0.44 110.841 175.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -57.32 -50.71 72.07 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.315 -0.857 . . . . 1.49 112.357 -178.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.619 ' CD2' ' HA ' ' A' ' 101' ' ' VAL . 1.2 p90 -66.86 -36.18 81.73 Favored 'General case' 0 CA--C 1.53 0.173 0 C-N-CA 120.584 -0.446 . . . . 3.29 110.404 -176.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 44.5 m -68.4 -40.73 81.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.253 -0.43 . . . . 1.1899999999999999 110.501 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -71.56 -34.52 70.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.883 -0.599 . . . . 2.8900000000000001 110.402 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.491 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -62.49 -42.01 99.74 Favored Glycine 0 N--CA 1.444 -0.823 0 C-N-CA 120.367 -0.921 . . . . 0.29999999999999999 110.89 174.271 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 1.053 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.29 -28.32 73.43 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.788 -0.72 . . . . 0.23000000000000001 111.683 174.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.97 -35.12 50.59 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.907 -0.172 . . . . 0.31 110.636 176.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.438 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -59.64 -38.81 82.39 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 107.904 -1.146 . . . . 1.1200000000000001 107.904 178.411 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.781 ' HB2' HD23 ' A' ' 13' ' ' LEU . 26.2 t -49.14 -63.12 1.19 Allowed 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 113.406 -1.725 . . . . 0.26000000000000001 109.824 171.605 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.94 ' HA ' HG13 ' A' ' 115' ' ' VAL . 42.5 t -62.27 -34.52 64.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 0.34999999999999998 111.667 -177.314 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.495 ' C ' HG21 ' A' ' 74' ' ' ILE . 32.8 mt-10 -57.0 -23.51 46.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.055 0.455 . . . . 2.5099999999999998 110.278 178.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.419 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 54.3 m -85.93 -43.62 13.07 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 108.479 -0.934 . . . . 0.28000000000000003 108.479 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.94 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.8 m -69.0 -29.04 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.079 0 CA-C-N 114.93 -1.032 . . . . 1.23 109.787 -176.055 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -50.53 -49.93 54.49 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 113.165 -1.834 . . . . 0.59999999999999998 110.995 174.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -86.81 11.19 13.8 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.554 -0.748 . . . . 1.6200000000000001 110.019 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 64.03 52.75 1.98 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 122.146 0.974 . . . . 1.8799999999999999 110.137 -175.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.419 ' CE ' ' HA ' ' A' ' 114' ' ' SER . 30.3 mtm -129.9 36.92 4.0 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.075 -1.42 . . . . 0.31 107.531 179.118 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.78 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 11.7 mp0 -53.84 -7.95 0.15 Allowed 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.637 -1.165 . . . . 1.1499999999999999 113.24 -178.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.51 HG23 HD22 ' A' ' 122' ' ' LEU . 20.9 m -67.06 -20.51 27.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 O-C-N 121.671 -0.643 . . . . 0.46000000000000002 111.997 175.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.699 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -75.05 -25.07 58.38 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 121.029 0.442 . . . . 0.26000000000000001 110.077 177.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.737 HG22 ' SG ' ' A' ' 111' ' ' CYS . 42.3 t -45.52 -51.87 2.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.617 -1.174 . . . . 0.25 112.355 -177.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.579 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 7.1 t -75.24 -34.27 61.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.884 0.374 . . . . 1.3500000000000001 110.76 -178.38 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.699 ' HD2' HD13 ' A' ' 122' ' ' LEU . 74.2 mtt180 -64.06 -51.39 64.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.445 . . . . 2.6699999999999999 110.591 -176.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.547 HG22 ' SD ' ' A' ' 130' ' ' MET . 73.4 mt -53.97 -50.05 56.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.572 -0.74 . . . . 0.23000000000000001 111.155 178.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -53.73 -36.11 61.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.893 0.378 . . . . 0.28999999999999998 111.517 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -61.5 -56.99 13.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.555 0.693 . . . . 0.28000000000000003 110.674 176.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -65.31 -32.01 73.44 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.809 -1.087 . . . . 3.9100000000000001 111.334 -176.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.547 ' SD ' HG22 ' A' ' 126' ' ' ILE . 90.3 mtp -64.51 -54.29 34.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.907 0.384 . . . . 1.0800000000000001 111.277 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.454 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -61.69 -41.02 97.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.027 -0.533 . . . . 0.25 111.151 -178.026 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 59.7 m -65.73 -43.24 89.65 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.808 -0.357 . . . . 0.40000000000000002 110.782 176.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.582 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 16.7 t80 -56.64 -40.11 74.88 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.707 -0.479 . . . . 3.1299999999999999 109.707 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.865 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.2 tt -61.1 -55.91 27.08 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.827 -0.805 . . . . 0.94999999999999996 108.827 172.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -50.63 -46.86 58.5 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.388 -0.823 . . . . 0.46000000000000002 112.862 -176.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -87.03 -47.43 8.94 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.127 0.489 . . . . 0.58999999999999997 111.8 -174.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . 0.582 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 66.8 m-70 -90.17 -50.89 5.74 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.829 -0.623 . . . . 1.45 112.253 -170.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.865 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -85.07 -44.84 12.66 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 113.555 0.946 . . . . 1.2 113.555 -168.52 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.628 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 29.6 tt0 -45.18 -51.25 25.41 Favored Pre-proline 0 C--N 1.32 -0.701 0 O-C-N 123.699 0.625 . . . . 0.75 112.596 -174.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.581 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 46.5 Cg_exo -55.7 -47.67 24.15 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 121.673 1.582 . . . . 0.56000000000000005 111.591 175.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . 0.439 ' O ' ' HB2' ' A' ' 144' ' ' GLU . 0.1 OUTLIER -57.43 -48.18 79.83 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.507 -0.77 . . . . 1.2 110.387 177.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.618 HD12 ' HA ' ' A' ' 139' ' ' GLU . 19.1 mt -51.54 -49.43 33.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.665 -0.698 . . . . 0.32000000000000001 111.531 175.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.628 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 80.5 mm-40 -60.98 -29.71 69.84 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.773 -0.649 . . . . 0.56999999999999995 111.263 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 13.2 mm-40 -64.57 -20.17 66.08 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 121.439 0.637 . . . . 0.78000000000000003 110.571 174.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.643 HD22 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -105.83 3.58 28.84 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.279 -0.873 . . . . 0.93000000000000005 109.517 -175.56 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 115.15 -30.47 6.76 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.157 -0.929 . . . . 0.56000000000000005 113.229 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.423 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 113.42 159.72 13.65 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 111.252 -0.739 . . . . 0.48999999999999999 111.252 -175.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.493 ' HB3' ' CB ' ' A' ' 46' ' ' VAL . 81.4 m95 -55.74 -30.77 61.75 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.491 0.552 . . . . 3.5699999999999998 112.491 -174.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.525 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 14.1 p-10 -63.32 -41.29 98.91 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.669 -0.412 . . . . 1.96 109.955 177.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.543 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 54.3 m -65.94 -32.53 74.08 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.841 -0.618 . . . . 0.67000000000000004 110.768 176.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.706 ' HD2' ' HH ' ' A' ' 155' ' ' TYR . 4.1 m-85 -60.28 -41.94 94.4 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.004 -0.544 . . . . 3.0 110.13 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.577 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -77.09 -25.28 15.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.155 0.503 . . . . 1.1499999999999999 110.233 177.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.525 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 8.9 mm-40 -58.74 -20.82 52.68 Favored 'General case' 0 C--N 1.324 -0.538 0 O-C-N 121.967 -0.458 . . . . 1.6699999999999999 110.124 173.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 150' ' ' THR . 2.6 mt -99.36 -55.62 2.63 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.884 -0.598 . . . . 1.3 110.419 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . 0.706 ' HH ' ' HD2' ' A' ' 151' ' ' PHE . 26.8 p90 -121.89 30.24 6.74 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.626 0.727 . . . . 4.2400000000000002 112.402 -173.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.627 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -66.52 163.58 42.96 Favored Glycine 0 C--N 1.303 -1.291 0 CA-C-N 114.804 -1.089 . . . . 1.1000000000000001 113.738 -177.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.423 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 28.5 t-20 -53.03 114.88 1.6 Allowed 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 113.604 -1.298 . . . . 1.29 112.088 -177.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.668 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 7.5 m120 -73.71 -28.13 61.56 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.058 -0.519 . . . . 2.9900000000000002 111.983 -176.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -54.38 -46.29 73.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.105 0.478 . . . . 2.52 110.431 178.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -76.68 -37.06 56.84 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.665 -0.698 . . . . 2.8700000000000001 110.656 175.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.603 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -55.88 -61.37 2.42 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.189 -0.459 . . . . 3.2000000000000002 111.396 -179.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.668 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 12.6 pt-20 -57.73 -35.51 70.79 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.623 0.249 . . . . 3.7200000000000002 111.458 178.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 46.0 t -61.22 -45.15 95.76 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.006 0.431 . . . . 4.1799999999999997 110.639 -177.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 11.9 mpt_? -84.42 -11.29 56.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.158 -0.473 . . . . 5.8200000000000003 110.79 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -89.35 -33.66 16.81 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.916 -0.584 . . . . 4.7699999999999996 110.42 -178.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -61.1 -30.66 74.25 Favored Glycine 0 N--CA 1.447 -0.572 0 CA-C-N 115.846 -0.615 . . . . 5.0999999999999996 112.943 -177.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -79.18 -14.06 59.32 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.975 0.417 . . . . 5.7199999999999998 110.618 178.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.58 ' HA ' ' HG2' ' A' ' 171' ' ' GLU . 37.2 mt-10 -90.43 4.93 49.56 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.043 -0.526 . . . . 5.8799999999999999 110.352 177.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.519 ' HG3' HD22 ' A' ' 170' ' ' LEU . 19.3 tpp180 -62.68 -46.83 86.34 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.807 -0.633 . . . . 7.3399999999999999 110.119 178.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.519 HD22 ' HG3' ' A' ' 169' ' ' ARG . 3.0 mm? -130.25 -24.97 2.51 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.842 -0.617 . . . . 6.9699999999999998 110.238 177.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . 0.58 ' HG2' ' HA ' ' A' ' 168' ' ' GLU . 50.2 mt-10 63.57 -174.13 0.16 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.412 -0.813 . . . . 6.9699999999999998 111.429 177.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 74.8 m80 -106.03 165.1 11.45 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.124 -0.695 . . . . 9.3499999999999996 109.124 175.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 50.4 t-80 -70.98 -41.35 71.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.132 0.492 . . . . 11.4 109.676 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -83.97 87.79 7.13 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.606 0.717 . . . . 11.52 109.549 172.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . 0.476 ' O ' ' HB2' ' A' ' 176' ' ' HIS . 33.6 t-80 -94.29 -34.07 12.98 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.851 -0.613 . . . . 14.48 110.572 -177.366 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . 0.476 ' HB2' ' O ' ' A' ' 175' ' ' HIS . 29.3 m80 73.4 135.43 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 O-C-N 124.006 0.816 . . . . 15.369999999999999 111.399 -177.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -155.67 155.0 32.43 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.283 -0.871 . . . . 16.02 109.303 -178.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.422 HD13 ' HA ' ' A' ' 178' ' ' LEU . 3.9 mm? -72.52 93.56 1.59 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.019 0.438 . . . . 17.989999999999998 111.119 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.69 -27.7 66.2 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.917 -0.771 . . . . 19.190000000000001 108.917 173.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 59.2 m80 -126.74 90.98 3.26 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.996 -1.002 . . . . 22.260000000000002 109.522 173.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 11.1 p80 -89.13 137.81 31.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.798 -0.637 . . . . 22.510000000000002 111.138 -177.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 58.19 84.06 0.11 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.603 -0.726 . . . . 24.890000000000001 111.38 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -74.93 -34.32 62.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.593 -0.73 . . . . 25.579999999999998 110.581 178.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 17.4 p80 -131.96 134.25 45.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.241 0.543 . . . . 27.370000000000001 110.565 -179.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 68.1 m-70 . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.406 -0.806 . . . . 29.059999999999999 110.161 -177.374 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.187 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -87.58 -66.92 1.32 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.778 -0.725 . . . . 2.9700000000000002 111.764 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.494 ' HB2' HE22 ' A' ' 71' ' ' GLN . 4.6 m 62.83 -148.85 0.35 Allowed 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 122.599 0.359 . . . . 1.9399999999999999 110.913 177.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.749 ' HA ' ' CD1' ' B' 1008 ' ' LEU . 0.3 OUTLIER 39.69 -88.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.34 0.188 0 O-C-N 124.682 1.239 . . . . 1.6299999999999999 113.682 176.349 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . -34.32 -35.04 0.04 OUTLIER Glycine 0 CA--C 1.536 1.389 0 O-C-N 123.395 0.434 . . . . 1.2 113.981 166.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -107.21 -44.73 4.28 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 117.329 0.564 . . . . 2.8799999999999999 112.446 175.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . 0.476 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -58.57 -64.24 1.0 Allowed 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 113.046 0.758 . . . . 1.3100000000000001 113.046 -165.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.749 ' CD1' ' HA ' ' B' 1004 ' ' VAL . 4.3 mp -71.0 -36.09 72.33 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-N 116.514 -0.312 . . . . 1.3300000000000001 110.352 -172.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 1.029 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -42.28 -45.21 4.12 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.38 -0.827 . . . . 0.88 110.245 168.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.794 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -77.16 -40.41 45.54 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 114.463 -1.244 . . . . 1.03 111.681 -178.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.496 ' CE1' ' H14' ' B' 1100 ' ' 33B . 39.2 m-85 -74.6 -30.27 61.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.784 0.326 . . . . 1.6699999999999999 111.312 -177.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . 0.902 ' HA2' ' HZ ' ' A' ' 57' ' ' PHE . . . -71.63 -11.45 72.81 Favored Glycine 0 N--CA 1.451 -0.356 0 CA-C-N 116.07 -0.514 . . . . 0.78000000000000003 112.79 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -74.88 -17.11 60.63 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.171 0.51 . . . . 1.8999999999999999 110.311 174.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 9.4 m -86.55 73.24 10.12 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.291 0.567 . . . . 1.4399999999999999 110.304 -178.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.758 HG21 ' HA3' ' A' ' 98' ' ' GLY . 6.4 pt -132.58 39.8 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.321 -0.854 . . . . 2.9100000000000001 109.337 176.023 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 17.0 m120 -106.36 -12.56 15.63 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.933 -1.031 . . . . 4.29 110.415 -175.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -107.35 91.25 3.58 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.68 -0.691 . . . . 8.1699999999999999 110.323 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.502 0 CA-C-N 116.557 -0.292 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.794 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.5 ttp . . . . . 0 N--CA 1.48 1.042 0 CA-C-O 120.556 0.217 . . . . 6.21 110.775 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.8 p -135.57 -49.27 0.71 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.588 0.232 . . . . 1.8700000000000001 111.41 -176.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -70.04 -1.76 10.79 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.966 0.358 . . . . 2.4199999999999999 111.966 -174.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.2 m -60.1 -24.35 64.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.133 -0.485 . . . . 1.25 111.273 179.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.544 ' HB2' HD13 ' A' ' 134' ' ' LEU . 6.2 p30 -57.45 -30.08 64.73 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.898 -0.592 . . . . 1.78 111.601 178.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.508 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 18.5 tpp85 -55.51 -49.92 71.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.895 -0.593 . . . . 1.3999999999999999 110.959 178.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.57 ' OE1' ' HA2' ' A' ' 40' ' ' GLY . 42.8 mt-10 -60.71 -43.13 98.21 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.679 -0.691 . . . . 0.68000000000000005 111.596 -176.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.567 HD21 ' HB3' ' A' ' 43' ' ' SER . 4.8 mt -63.3 -34.84 78.57 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.237 -0.892 . . . . 1.1599999999999999 109.534 -175.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.511 HG13 ' HE2' ' A' ' 130' ' ' MET . 53.4 t -68.63 -63.83 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.461 0 CA-C-N 115.51 -0.768 . . . . 0.27000000000000002 109.586 173.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 6' ' ' ARG . 97.9 t -49.55 -55.06 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.371 -0.831 . . . . 0.33000000000000002 113.033 -176.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -57.66 -33.25 68.12 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.201 0.313 . . . . 0.58999999999999997 111.067 -173.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.667 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 20.4 t80 -83.64 -39.32 20.41 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 120.573 -0.451 . . . . 1.6100000000000001 111.464 -177.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.992 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 4.0 mp -58.04 -40.34 80.68 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 119.666 -0.813 . . . . 0.34000000000000002 109.286 175.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.443 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 47.8 t -60.08 -41.72 93.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.428 -0.806 . . . . 1.05 110.548 175.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 85.6 t80 -66.08 -30.47 70.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.908 -0.587 . . . . 1.22 110.935 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.825 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 14.8 mmmt -73.05 -48.67 34.0 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 121.453 0.644 . . . . 1.4099999999999999 109.852 -178.378 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.639 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . 10.8 mt -56.54 -33.27 65.92 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.516 -0.765 . . . . 1.3500000000000001 111.002 172.339 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 21.8 t -68.23 -24.81 64.96 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.876 -0.602 . . . . 0.93999999999999995 111.893 -178.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.825 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 23.2 pt20 -77.18 -16.65 59.02 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-O 121.395 0.617 . . . . 1.3700000000000001 110.304 -177.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.696 ' HD2' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -105.04 -24.62 12.78 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.943 -1.026 . . . . 2.2000000000000002 109.365 -179.364 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.04 23.14 8.74 Favored Glycine 0 N--CA 1.439 -1.115 0 CA-C-N 114.189 -1.369 . . . . 0.53000000000000003 112.936 176.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -99.22 164.58 12.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.737 0.304 . . . . 0.76000000000000001 110.295 172.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.1 t -103.22 148.28 25.99 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.145 0.497 . . . . 0.52000000000000002 110.671 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.651 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 58.3 t-105 -75.53 -54.26 7.29 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.433 -0.803 . . . . 3.3599999999999999 109.557 174.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.1 m -62.4 -32.8 73.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.703 -0.68 . . . . 1.3700000000000001 111.948 -173.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -60.29 -28.83 68.4 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 111.921 0.341 . . . . 1.1100000000000001 111.921 -178.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -117.27 -2.44 11.61 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.222 0.453 . . . . 1.28 112.222 -175.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.628 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 51.5 m -102.04 155.48 18.15 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-O 122.155 0.978 . . . . 1.8100000000000001 113.181 -175.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -130.79 -0.22 4.29 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 113.321 -1.763 . . . . 2.3100000000000001 109.163 -178.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.888 HG23 ' H ' ' A' ' 31' ' ' GLU . 4.9 m -59.99 -75.68 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 114.434 -1.257 . . . . 0.92000000000000004 113.239 -167.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.888 ' H ' HG23 ' A' ' 30' ' ' VAL . 33.1 mm-40 -92.03 -2.9 56.44 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.679 -0.859 . . . . 2.7400000000000002 108.679 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -64.08 -41.97 97.13 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.717 -1.129 . . . . 1.45 110.711 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -101.26 -53.9 2.91 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.517 -0.765 . . . . 1.8700000000000001 110.731 -175.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.551 ' O ' ' HA ' ' A' ' 31' ' ' GLU . 17.6 ptt180 -113.48 133.55 55.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.051 0.453 . . . . 3.3900000000000001 110.538 176.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.6 p -96.45 107.31 19.69 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.735 -0.666 . . . . 2.25 110.345 179.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -95.31 -66.35 0.92 Allowed 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.38 -0.827 . . . . 3.3399999999999999 111.415 -173.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.508 ' HB2' ' HB3' ' A' ' 6' ' ' ARG . . . -92.92 154.45 41.9 Favored Pre-proline 0 C--N 1.317 -0.829 0 CA-C-N 115.672 -0.695 . . . . 1.9199999999999999 111.334 -177.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.523 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 27.2 Cg_exo -63.39 -176.87 0.33 Allowed 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 123.323 2.682 . . . . 1.8700000000000001 112.426 177.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -81.08 9.71 6.3 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.307 0.575 . . . . 4.6399999999999997 110.509 179.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.57 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 130.04 72.87 0.13 Allowed Glycine 0 N--CA 1.441 -1.014 0 N-CA-C 110.991 -0.843 . . . . 2.1499999999999999 110.991 -176.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.874 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.8 t -76.6 -77.35 0.14 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 120.369 -0.533 . . . . 1.1200000000000001 110.371 -175.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.874 ' H ' HG23 ' A' ' 41' ' ' THR . 11.1 pt-20 -94.08 -30.44 14.66 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 123.011 1.386 . . . . 2.02 107.783 165.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.6 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.0 OUTLIER -60.86 -25.66 66.83 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 112.135 -2.302 . . . . 1.25 113.43 -171.245 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -53.08 -51.36 62.07 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 120.758 0.313 . . . . 1.9099999999999999 110.635 179.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.548 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -74.62 -35.6 62.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.07 0.462 . . . . 0.52000000000000002 110.212 178.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.704 ' HA ' ' CG1' ' A' ' 152' ' ' VAL . 95.1 t -58.91 -60.42 2.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.295 -0.866 . . . . 1.4099999999999999 111.372 179.074 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.579 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 11.6 ptpt -59.36 -35.57 74.15 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.258 -0.645 . . . . 0.67000000000000004 109.258 -178.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.713 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -66.63 -30.33 70.58 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.404 -0.817 . . . . 0.98999999999999999 110.654 -179.616 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.804 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -83.5 -38.46 21.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.243 0.544 . . . . 0.41999999999999998 110.463 176.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.513 HD12 ' CE2' ' A' ' 151' ' ' PHE . 0.8 OUTLIER -65.88 -27.31 68.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.382 -0.827 . . . . 1.3300000000000001 111.576 -176.368 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.713 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 6.4 ptp180 -81.41 -24.11 37.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.385 0.612 . . . . 2.1699999999999999 109.494 -178.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -75.49 -44.97 41.15 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.927 -1.033 . . . . 1.1000000000000001 109.271 174.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.78 -43.58 95.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.512 -0.767 . . . . 0.53000000000000003 109.885 173.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.645 ' O ' ' HG2' ' A' ' 58' ' ' GLU . . . -65.73 -32.82 84.21 Favored Glycine 0 C--O 1.221 -0.663 0 CA-C-N 115.356 -0.838 . . . . 0.69999999999999996 112.058 177.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -57.96 -48.02 81.22 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.842 -0.429 . . . . 1.04 109.842 178.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -66.42 -27.33 67.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.339 -0.846 . . . . 2.29 111.17 175.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.619 ' CE2' ' HA ' ' A' ' 102' ' ' ALA . 5.4 t80 -80.76 -27.86 36.64 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.32 -0.4 . . . . 2.29 111.47 -178.222 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.645 ' HG2' ' O ' ' A' ' 54' ' ' GLY . 36.9 mm-40 -49.82 -69.04 0.13 Allowed 'General case' 0 CA--C 1.508 -0.637 0 N-CA-C 112.216 0.451 . . . . 1.3 112.216 -178.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.809 ' H ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -53.98 -35.45 61.84 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.248 -0.887 . . . . 1.54 111.343 -179.443 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.711 ' N ' HD22 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -51.63 -62.07 1.85 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.607 -0.724 . . . . 2.5800000000000001 112.33 175.681 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.454 ' HD1' ' HB3' ' A' ' 65' ' ' PHE . 31.1 p90 -90.98 -11.41 39.01 Favored 'General case' 0 N--CA 1.462 0.173 0 N-CA-C 112.022 0.378 . . . . 5.3200000000000003 112.022 -175.444 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.757 ' HG3' ' HE1' ' A' ' 65' ' ' PHE . 43.0 ttm180 -62.38 -29.72 70.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.674 0.273 . . . . 4.4800000000000004 111.277 -175.806 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -64.84 -35.14 80.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.345 -0.389 . . . . 4.7199999999999998 110.622 177.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.408 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -91.52 -50.4 5.8 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.396 0.517 . . . . 1.1699999999999999 112.396 -176.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.971 ' HA ' ' HB2' ' A' ' 68' ' ' LEU . 1.3 p90 -57.59 -27.32 62.61 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 112.581 0.586 . . . . 2.8100000000000001 112.581 -166.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.6 p -64.29 -33.35 75.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.01 0.433 . . . . 2.1899999999999999 110.539 177.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -90.28 -32.45 16.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.496 0.665 . . . . 2.7200000000000002 109.738 174.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.971 ' HB2' ' HA ' ' A' ' 65' ' ' PHE . 3.3 mp -60.1 -19.73 54.79 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-N 115.205 -0.907 . . . . 1.5600000000000001 112.506 -177.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.663 HG22 HG13 ' A' ' 74' ' ' ILE . 1.3 p -58.15 -28.43 64.7 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 118.29 0.496 . . . . 0.69999999999999996 111.114 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 21.8 t -71.53 -37.3 71.19 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 109.365 -0.606 . . . . 1.3400000000000001 109.365 173.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.45 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 13.2 mt-30 -68.44 -40.18 81.25 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.432 -0.804 . . . . 1.4199999999999999 110.088 178.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.443 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.0 mm? -68.72 -32.56 72.44 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.609 -0.269 . . . . 1.3700000000000001 110.64 172.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.5 m80 60.84 49.23 6.19 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.476 -0.935 . . . . 2.7200000000000002 108.476 -170.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.663 HG13 HG22 ' A' ' 69' ' ' THR . 33.1 mm -51.3 113.05 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 113.805 -1.543 . . . . 0.91000000000000003 112.325 -176.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.775 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -154.55 -172.93 0.34 Allowed Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 107.522 -1.288 . . . . 0.51000000000000001 107.522 -171.804 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.775 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 24.4 Cg_exo -29.91 166.28 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.332 0 C-N-CA 125.185 3.923 . . . . 0.46999999999999997 115.466 166.224 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.514 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.26 -31.2 0.01 OUTLIER Glycine 0 N--CA 1.472 1.048 0 N-CA-C 117.307 1.683 . . . . 0.40000000000000002 117.307 -173.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 76' ' ' PRO . 18.2 p -66.14 2.03 1.3 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 117.653 0.726 . . . . 0.56000000000000005 112.243 -179.065 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.25 -12.46 61.69 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.182 0.515 . . . . 0.34000000000000002 110.012 172.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.509 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 5.5 p90 -73.58 -21.76 60.25 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 109.212 -0.662 . . . . 4.1299999999999999 109.212 175.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.458 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 37.4 mt-30 -80.82 -25.58 37.69 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.867 0.841 . . . . 1.03 109.553 175.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.9 m -71.34 -51.67 22.96 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 114.482 -1.235 . . . . 0.47999999999999998 109.524 172.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.598 ' HE1' ' HB2' ' A' ' 106' ' ' PHE . 78.5 t80 -68.87 -18.65 64.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.057 -0.974 . . . . 1.1799999999999999 110.467 176.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.619 ' HA ' HG12 ' A' ' 87' ' ' VAL . 37.4 tt0 -59.51 -49.25 78.5 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.391 -0.822 . . . . 0.80000000000000004 110.339 176.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.47 ' OE1' HG21 ' B' 1004 ' ' VAL . 66.1 mt-30 -48.45 -32.6 7.99 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.805 -1.089 . . . . 1.6200000000000001 110.737 176.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.784 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.5 t -83.83 -53.07 11.99 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-N 114.803 -1.09 . . . . 1.3 110.815 -177.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.619 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.6 p -61.44 -23.92 32.03 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-O 121.492 0.663 . . . . 0.84999999999999998 109.602 -179.057 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.695 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.6 m-80 -68.47 -52.77 28.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.581 -1.191 . . . . 0.91000000000000003 111.102 174.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.937 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 0.8 OUTLIER -63.22 -36.54 83.98 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-O 121.881 0.848 . . . . 2.8700000000000001 108.762 -178.303 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.637 ' HG ' ' CD ' ' A' ' 89' ' ' GLU . 19.1 mt -68.89 -22.35 64.19 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 113.731 -1.577 . . . . 1.28 112.527 -167.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.73 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 5.6 p90 -106.79 -32.11 8.1 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 120.494 -0.483 . . . . 2.2999999999999998 111.842 -174.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.695 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.0 OUTLIER -81.54 -24.41 36.62 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.243 0.544 . . . . 5.0599999999999996 110.854 -172.689 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.474 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 0.4 OUTLIER -98.53 18.52 16.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.518 -0.764 . . . . 3.1200000000000001 112.713 -170.249 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 116.19 68.88 0.42 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 117.829 -2.129 . . . . 2.3100000000000001 114.756 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.73 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 63.5 t -70.49 105.39 1.42 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 CA-C-N 118.276 1.038 . . . . 1.0600000000000001 111.277 -176.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.467 ' ND2' ' HG2' ' A' ' 99' ' ' ARG . 3.5 p30 -110.12 -170.66 1.69 Allowed 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 113.675 -1.602 . . . . 2.1200000000000001 108.229 172.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.828 ' HB3' ' HD1' ' A' ' 151' ' ' PHE . 23.2 m-90 -62.86 -35.06 78.73 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.84 0.352 . . . . 3.3399999999999999 110.633 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.452 ' HA2' HG13 ' A' ' 101' ' ' VAL . . . -73.75 -38.47 50.05 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.996 -0.547 . . . . 0.68999999999999995 113.697 -176.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.467 ' HG2' ' ND2' ' A' ' 96' ' ' ASN . 16.1 mmt180 -54.19 -31.74 53.75 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.225 0.536 . . . . 4.2400000000000002 111.563 -178.515 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.429 HG12 ' HG ' ' A' ' 138' ' ' LEU . 78.9 mt -83.19 -34.16 10.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.954 -0.566 . . . . 0.44 111.653 -174.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.452 HG13 ' HA2' ' A' ' 98' ' ' GLY . 1.1 m -66.93 -25.97 35.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 109.344 -0.613 . . . . 1.3500000000000001 109.344 171.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.619 ' HA ' ' CE2' ' A' ' 57' ' ' PHE . . . -68.5 -51.87 38.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.194 0.521 . . . . 0.44 109.71 172.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -49.37 -54.56 16.7 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.5 -1.227 . . . . 1.49 111.936 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.507 ' HA ' ' CE ' ' A' ' 130' ' ' MET . 0.3 OUTLIER -73.49 -19.08 61.03 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 120.645 -0.422 . . . . 3.29 111.441 -172.844 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.667 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 67.9 m -77.31 -49.27 15.35 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.509 0.195 . . . . 1.1899999999999999 110.653 177.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.651 ' CZ ' HD12 ' B' 1008 ' ' LEU . 19.2 m-85 -60.51 -39.55 88.18 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 110.092 -0.336 . . . . 2.8900000000000001 110.092 177.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.893 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -65.99 -38.98 94.63 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.875 -0.678 . . . . 0.29999999999999999 111.959 177.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.992 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.6 -40.8 99.04 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.612 -0.804 . . . . 0.23000000000000001 111.362 175.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.13 -32.2 66.71 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.771 0.32 . . . . 0.31 110.76 177.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.544 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -58.31 -39.89 80.58 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 108.377 -0.972 . . . . 1.1200000000000001 108.377 179.48 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.75 ' SG ' HG22 ' A' ' 123' ' ' VAL . 40.1 t -51.25 -64.11 0.92 Allowed 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 113.713 -1.585 . . . . 0.26000000000000001 110.247 173.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.835 ' HA ' HG13 ' A' ' 115' ' ' VAL . 44.6 t -61.57 -37.17 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-N 116.508 -0.314 . . . . 0.34999999999999998 111.826 -175.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.476 ' HG3' ' CG2' ' A' ' 69' ' ' THR . 4.0 mm-40 -60.21 -21.81 62.22 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.105 0.479 . . . . 2.5099999999999998 110.67 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.435 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 70.3 m -83.74 -42.77 16.19 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 108.061 -1.088 . . . . 0.28000000000000003 108.061 179.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.835 HG13 ' HA ' ' A' ' 112' ' ' VAL . 1.6 m -68.9 -28.79 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-N 114.796 -1.093 . . . . 1.23 109.515 -177.44 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -51.67 -51.03 59.1 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 113.26 -1.791 . . . . 0.59999999999999998 110.919 174.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 15.5 mmtp -84.7 13.92 5.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.523 -0.762 . . . . 1.6200000000000001 110.285 179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 65.31 46.12 2.71 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 121.95 0.881 . . . . 1.8799999999999999 109.976 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.435 ' CE ' ' HA ' ' A' ' 114' ' ' SER . 26.8 mtm -126.7 38.24 4.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.559 -1.201 . . . . 0.31 107.889 -178.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.753 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 10.2 mp0 -54.68 -8.05 0.21 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 114.775 -1.102 . . . . 1.1499999999999999 113.048 -179.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.582 HG23 HD22 ' A' ' 122' ' ' LEU . 16.5 m -64.0 -27.56 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 O-C-N 121.831 -0.543 . . . . 0.46000000000000002 111.477 174.051 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.582 HD22 HG23 ' A' ' 121' ' ' VAL . 3.2 mm? -70.04 -25.48 63.58 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 110.235 -0.284 . . . . 0.26000000000000001 110.235 178.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.75 HG22 ' SG ' ' A' ' 111' ' ' CYS . 55.2 t -47.7 -51.38 7.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.587 -0.733 . . . . 0.25 111.819 -178.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.628 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 14.6 t -75.62 -31.48 59.89 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.881 0.372 . . . . 1.3500000000000001 110.598 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.499 ' NH1' ' HA3' ' A' ' 77' ' ' GLY . 58.6 mtp180 -66.42 -55.25 16.66 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 116.205 -0.452 . . . . 2.6699999999999999 110.418 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.544 HD13 ' HB3' ' A' ' 110' ' ' LEU . 87.7 mt -53.64 -42.82 52.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 115.591 -0.731 . . . . 0.23000000000000001 111.799 -175.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.651 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -60.27 -35.0 74.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.923 -0.311 . . . . 0.28999999999999998 110.89 178.371 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.459 ' HB3' ' O ' ' A' ' 125' ' ' ARG . . . -64.15 -59.76 4.04 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.636 0.731 . . . . 0.28000000000000003 109.832 176.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.495 ' HD1' ' O ' ' A' ' 125' ' ' ARG . 94.3 m95 -54.05 -46.15 71.86 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.251 -1.34 . . . . 3.9100000000000001 110.437 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.893 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 1.4 mmm -59.15 -59.41 5.51 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.784 -0.644 . . . . 1.0800000000000001 112.067 -177.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -59.81 -36.05 75.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 120.685 -0.406 . . . . 0.25 110.392 -177.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.429 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 23.3 m -64.49 -49.22 72.23 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.601 -0.272 . . . . 0.40000000000000002 111.571 176.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.486 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 14.1 m-85 -58.0 -36.37 72.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.766 0.317 . . . . 3.1299999999999999 110.351 178.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.733 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 5.5 tt -64.85 -51.06 64.09 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.986 -0.746 . . . . 0.94999999999999996 108.986 171.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . 0.429 ' HB2' ' HA ' ' A' ' 132' ' ' THR . 4.5 m-80 -48.7 -49.59 37.2 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.07 0.548 . . . . 0.46000000000000002 112.034 178.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -80.15 -50.59 10.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.258 -0.428 . . . . 0.58999999999999997 111.897 -174.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . 0.486 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 22.2 m-70 -90.69 -51.69 5.25 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 113.067 0.765 . . . . 1.45 113.067 -170.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.733 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.1 OUTLIER -82.71 -45.89 13.87 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.291 0.848 . . . . 1.2 113.291 -167.078 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.69 ' HA ' HD12 ' A' ' 142' ' ' ILE . 22.8 tt0 -42.08 -53.64 8.24 Favored Pre-proline 0 CA--C 1.542 0.652 0 O-C-N 124.123 0.89 . . . . 0.75 113.167 -172.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.49 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 19.3 Cg_endo -61.09 -47.6 12.12 Favored 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 121.889 1.726 . . . . 0.56000000000000005 111.998 178.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -55.37 -46.92 76.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.72 -0.673 . . . . 1.2 110.065 177.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.69 HD12 ' HA ' ' A' ' 139' ' ' GLU . 48.4 mt -49.08 -52.06 11.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.793 -0.64 . . . . 0.32000000000000001 111.798 175.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 73.8 mm-40 -59.9 -30.67 69.18 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.984 -0.553 . . . . 0.56999999999999995 111.434 -179.061 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.7 mm-40 -65.63 -20.81 66.46 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.705 0.764 . . . . 0.78000000000000003 110.594 176.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -111.29 10.92 21.67 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.002 -0.999 . . . . 0.93000000000000005 109.917 -175.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 114.39 -46.84 1.11 Allowed Glycine 0 N--CA 1.44 -1.044 0 CA-C-N 114.861 -1.063 . . . . 0.56000000000000005 112.813 173.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.581 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 131.56 178.46 15.49 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.717 -0.754 . . . . 0.48999999999999999 111.9 -177.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.525 ' NE1' HD13 ' A' ' 142' ' ' ILE . 7.0 m-90 -68.54 -41.9 79.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.62 0.248 . . . . 3.5699999999999998 110.778 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.43 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 23.3 t70 -59.84 -37.75 80.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.32 0.581 . . . . 1.96 109.862 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.644 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 62.2 m -60.93 -37.53 82.63 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.306 -0.861 . . . . 0.67000000000000004 111.183 179.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.828 ' HD1' ' HB3' ' A' ' 97' ' ' TRP . 74.6 t80 -59.33 -40.53 86.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.059 0.457 . . . . 3.0 109.954 177.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.704 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.3 m -74.6 -24.89 18.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.475 0.655 . . . . 1.1499999999999999 110.094 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 31.8 mm-40 -66.38 -22.9 66.25 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.396 0.617 . . . . 1.6699999999999999 110.082 172.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.644 ' HG ' ' O ' ' A' ' 150' ' ' THR . 4.7 mt -93.82 -58.53 2.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.648 -0.705 . . . . 1.3 110.552 177.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -122.07 30.16 6.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.047 -0.524 . . . . 4.2400000000000002 111.594 -173.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.804 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -62.95 155.72 41.87 Favored Glycine 0 CA--C 1.502 -0.764 0 CA-C-O 121.654 0.585 . . . . 1.1000000000000001 113.682 -177.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.431 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 21.6 t-20 -54.99 132.02 46.06 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 113.842 -1.179 . . . . 1.29 110.283 175.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.491 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 6.6 p-10 -80.02 17.97 0.9 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.454 0.538 . . . . 2.9900000000000002 112.454 -174.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.407 ' HB2' ' OD1' ' A' ' 157' ' ' ASN . . . -49.37 -41.28 38.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.678 0.275 . . . . 2.52 111.549 177.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -74.4 -36.94 63.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.55 -0.295 . . . . 2.8700000000000001 110.511 179.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.441 ' HB3' ' HB2' ' A' ' 158' ' ' ASN . . . -54.78 -59.31 4.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.058 -0.519 . . . . 3.2000000000000002 111.113 177.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.548 ' O ' ' HB3' ' A' ' 165' ' ' LYS . 4.5 pt-20 -66.35 -25.62 66.9 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.153 -0.476 . . . . 3.7200000000000002 111.834 179.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 7.6 t -70.42 -33.35 71.24 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.372 -0.603 . . . . 4.1799999999999997 109.372 176.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 40.3 mmt180 -72.15 -39.41 68.77 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.4 0.619 . . . . 5.8200000000000003 109.478 172.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.548 ' HB3' ' O ' ' A' ' 162' ' ' GLU . 24.4 ttpt -48.7 -49.68 36.8 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.236 -1.347 . . . . 4.7699999999999996 111.503 178.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -63.51 -40.01 98.28 Favored Glycine 0 N--CA 1.447 -0.573 0 CA-C-N 115.818 -0.628 . . . . 5.0999999999999996 113.39 -174.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -85.59 -18.84 32.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.984 0.421 . . . . 5.7199999999999998 111.288 -178.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.532 ' HG2' ' HB2' ' A' ' 172' ' ' HIS . 35.0 tt0 -73.79 -12.96 60.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.855 -0.611 . . . . 5.8799999999999999 110.085 176.445 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -56.06 -36.33 67.94 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.344 -0.844 . . . . 7.3399999999999999 111.291 -175.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -76.81 -50.87 12.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.353 -0.385 . . . . 6.9699999999999998 111.995 -176.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -78.86 -30.85 45.31 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 111.963 0.356 . . . . 6.9699999999999998 111.963 -173.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . 0.532 ' HB2' ' HG2' ' A' ' 168' ' ' GLU . 94.6 m-70 -121.78 110.09 15.49 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.97 0.414 . . . . 9.3499999999999996 109.933 177.42 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 51.4 m-70 -90.14 116.56 28.24 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.861 -0.609 . . . . 11.4 110.724 -176.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -68.56 -40.94 80.43 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.067 -0.716 . . . . 11.52 109.067 174.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -95.6 110.89 22.92 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.973 -0.751 . . . . 14.48 108.973 169.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -93.65 9.13 38.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.956 -0.565 . . . . 15.369999999999999 110.909 -174.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -142.38 135.27 28.42 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.668 -0.697 . . . . 16.02 110.382 173.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 43.6 tp -141.4 -70.14 0.37 Allowed 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.208 -0.664 . . . . 17.989999999999998 109.208 177.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -137.61 158.79 43.62 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.615 -0.72 . . . . 19.190000000000001 109.732 178.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 50.1 m80 -100.51 -70.11 0.75 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.393 -0.367 . . . . 22.260000000000002 110.181 -178.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 10.5 m170 66.52 159.94 0.14 Allowed 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.736 -0.665 . . . . 22.510000000000002 111.774 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 58.53 -96.51 0.06 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.377 -0.829 . . . . 24.890000000000001 111.266 -176.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 35.9 m80 -151.24 142.71 23.49 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.804 0.335 . . . . 25.579999999999998 110.641 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -96.55 126.69 41.91 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.185 -0.672 . . . . 27.370000000000001 109.185 175.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 55.4 t60 . . . . . 0 C--O 1.246 0.881 0 CA-C-O 118.312 -0.852 . . . . 29.059999999999999 109.911 -177.817 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.206 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . 78.42 -84.43 1.18 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.001 -0.619 . . . . 2.9700000000000002 112.526 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.446 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . 30.4 m -122.51 -153.2 0.54 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.98 -0.378 . . . . 1.9399999999999999 109.98 -178.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.996 HG23 ' H ' ' B' 1005 ' ' GLY . 13.5 m 50.74 -88.36 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 C-N-CA 124.849 1.259 . . . . 1.6299999999999999 112.985 172.126 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 0.996 ' H ' HG23 ' B' 1004 ' ' VAL . . . -34.94 -36.73 0.08 OUTLIER Glycine 0 CA--C 1.53 1.008 0 CA-C-N 119.078 0.854 . . . . 1.2 112.954 161.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . 0.539 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 6.9 mpt_? -89.23 -51.47 5.56 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.846 0.355 . . . . 2.8799999999999999 111.281 174.405 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . 0.577 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -69.07 -62.83 1.22 Allowed 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 113.244 0.831 . . . . 1.3100000000000001 113.244 -167.054 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.651 HD12 ' CZ ' ' A' ' 106' ' ' PHE . 3.2 mm? -58.63 -53.23 60.72 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.149 -0.315 . . . . 1.3300000000000001 110.149 -176.307 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 0.937 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -38.0 -50.43 1.33 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.102 -0.954 . . . . 0.88 111.991 171.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.804 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -70.2 -47.88 59.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.084 -0.962 . . . . 1.03 111.706 -177.25 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.557 ' HE2' ' H8 ' ' B' 1100 ' ' 33B . 31.5 m-85 -66.52 -27.42 67.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.007 0.432 . . . . 1.6699999999999999 111.247 -179.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -73.67 -11.14 80.54 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.939 -0.573 . . . . 0.78000000000000003 112.905 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 36.0 t70 -76.51 -5.32 47.04 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.17 0.509 . . . . 1.8999999999999999 110.647 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 10.0 m -96.85 8.2 44.9 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.09 -0.505 . . . . 1.4399999999999999 111.053 -177.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.435 HD11 ' CE1' ' A' ' 57' ' ' PHE . 26.6 mt -93.62 67.52 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.495 0.664 . . . . 2.9100000000000001 109.835 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -129.46 -42.95 1.29 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.331 -0.85 . . . . 4.29 109.86 178.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 -119.19 92.06 3.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.803 -0.635 . . . . 8.1699999999999999 110.213 176.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.584 0 CA-C-N 116.583 -0.281 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.804 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.2 mtt . . . . . 0 N--CA 1.483 1.189 0 CA-C-O 120.922 0.391 . . . . 6.21 110.807 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.441 ' HB2' ' OD1' ' A' ' 135' ' ' ASN . 3.0 p -79.2 0.95 26.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.894 0.378 . . . . 1.8700000000000001 111.713 -176.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 -102.0 -2.78 28.9 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 122.058 -0.401 . . . . 2.4199999999999999 110.812 175.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.1 t -86.67 -22.58 26.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.963 0.411 . . . . 1.25 110.731 -177.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.783 ' HA ' HD22 ' A' ' 8' ' ' LEU . 8.2 p30 -67.75 -22.66 65.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.106 0.479 . . . . 1.78 110.05 173.236 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.965 HH12 ' HA ' ' A' ' 128' ' ' ALA . 21.1 tpp180 -55.56 -49.6 72.26 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-N 115.263 -0.88 . . . . 1.3999999999999999 109.778 175.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -56.3 -52.28 65.09 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.475 -1.239 . . . . 0.68000000000000005 111.176 -177.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.783 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.8 OUTLIER -44.54 -43.73 8.21 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.269 -0.878 . . . . 1.1599999999999999 111.167 175.733 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.461 HG13 ' HE2' ' A' ' 130' ' ' MET . 76.1 t -72.17 -61.41 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.337 0.589 . . . . 0.27000000000000002 110.482 176.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 6' ' ' ARG . 68.2 t -52.91 -52.71 26.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.062 -0.972 . . . . 0.33000000000000002 113.036 -174.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -55.7 -34.52 65.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.066 0.46 . . . . 0.58999999999999997 110.549 -175.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.696 ' CE2' ' HA ' ' A' ' 105' ' ' SER . 24.2 t80 -80.38 -43.01 21.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 116.102 -0.499 . . . . 1.6100000000000001 111.132 -178.052 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.834 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 3.9 mp -59.02 -41.63 88.24 Favored 'General case' 0 CA--C 1.522 -0.113 0 C-N-CA 120.066 -0.654 . . . . 0.34000000000000002 109.526 176.408 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 m -55.58 -43.21 75.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.641 -0.709 . . . . 1.05 110.604 176.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -71.45 -33.61 69.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.416 -0.811 . . . . 1.22 110.831 -177.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.711 ' HE2' ' HA ' ' A' ' 16' ' ' LYS . 9.9 mmpt? -76.54 -27.87 56.09 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.509 -0.314 . . . . 1.4099999999999999 111.593 -177.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.597 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -73.55 -29.51 62.49 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 120.103 -0.639 . . . . 1.3500000000000001 109.871 174.512 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.3 t -65.57 -28.83 69.43 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.79 -0.641 . . . . 0.93999999999999995 111.526 -176.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 28.5 pt20 -79.14 -5.88 55.21 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.433 0.635 . . . . 1.3700000000000001 110.86 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.488 ' HD2' ' HG3' ' A' ' 19' ' ' GLN . 18.6 mmmt -108.77 -25.17 10.95 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 122.148 0.975 . . . . 2.2000000000000002 108.946 -179.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.81 25.78 7.88 Favored Glycine 0 N--CA 1.44 -1.061 0 CA-C-N 113.605 -1.634 . . . . 0.53000000000000003 111.227 179.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -120.33 166.74 13.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.315 -0.442 . . . . 0.76000000000000001 110.669 177.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.503 ' HB3' ' HG3' ' A' ' 26' ' ' GLN . 4.6 t -112.35 149.8 31.96 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 116.071 -0.513 . . . . 0.52000000000000002 110.327 178.25 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.423 ' CE2' HG13 ' A' ' 10' ' ' VAL . 2.8 t90 -67.63 -50.65 56.99 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.031 0.443 . . . . 3.3599999999999999 109.963 172.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.511 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 3.8 p -64.08 -31.65 72.92 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.559 -0.746 . . . . 1.3700000000000001 111.738 -171.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.503 ' HG3' ' HB3' ' A' ' 23' ' ' SER . 95.0 mt-30 -56.4 -27.42 56.36 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.924 0.392 . . . . 1.1100000000000001 111.371 178.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -120.61 11.33 11.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.26 -0.427 . . . . 1.28 111.382 -175.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.604 ' HA ' ' HB3' ' A' ' 124' ' ' SER . 59.0 p -98.02 -178.05 3.95 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.784 0.661 . . . . 1.8100000000000001 112.784 -170.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.53 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 11.1 t70 -170.66 -26.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 114.649 -1.16 . . . . 2.3100000000000001 109.441 -177.408 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.896 HG23 ' H ' ' A' ' 31' ' ' GLU . 6.6 m -47.43 -72.21 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 CA-C-N 114.586 -1.188 . . . . 0.92000000000000004 112.866 -174.077 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.896 ' H ' HG23 ' A' ' 30' ' ' VAL . 7.9 pt-20 -102.48 1.17 34.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.483 0.659 . . . . 2.7400000000000002 109.386 175.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.53 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 15.5 tt0 -58.21 -42.21 85.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.017 -0.992 . . . . 1.45 111.435 -179.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -90.27 4.41 50.75 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.349 -0.842 . . . . 1.8700000000000001 113.024 -171.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -149.46 143.85 25.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.222 0.534 . . . . 3.3900000000000001 111.896 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 7.0 p -111.17 100.15 8.86 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.729 -0.668 . . . . 2.25 110.146 176.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -135.46 -71.18 0.47 Allowed 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.659 -0.701 . . . . 3.3399999999999999 111.839 -167.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.639 ' HB1' ' HD2' ' A' ' 38' ' ' PRO . . . -66.08 160.8 61.22 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.848 -0.614 . . . . 1.9199999999999999 112.545 -174.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.697 ' HB2' ' H ' ' A' ' 40' ' ' GLY . 31.5 Cg_endo -60.58 174.42 1.62 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 124.44 3.427 . . . . 1.8700000000000001 113.016 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -84.07 -1.73 55.39 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.562 -0.903 . . . . 4.6399999999999997 108.562 168.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.697 ' H ' ' HB2' ' A' ' 38' ' ' PRO . . . 146.89 81.47 0.04 OUTLIER Glycine 0 N--CA 1.437 -1.244 0 CA-C-N 114.018 -1.447 . . . . 2.1499999999999999 111.022 -179.334 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.862 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.8 t -64.27 -73.91 0.11 Allowed 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 109.29 -0.633 . . . . 1.1200000000000001 109.29 -176.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.862 ' H ' HG23 ' A' ' 41' ' ' THR . 13.7 pt-20 -93.28 -29.87 15.45 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 122.66 1.219 . . . . 2.02 108.418 164.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.716 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 6.7 p -60.42 -23.35 64.31 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 112.595 -2.093 . . . . 1.25 113.77 -170.241 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -55.91 -46.02 78.54 Favored 'General case' 0 C--N 1.317 -0.809 0 C-N-CA 120.124 -0.63 . . . . 1.9099999999999999 109.9 179.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.511 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -76.57 -34.94 58.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.071 0.462 . . . . 0.52000000000000002 110.35 177.04 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.716 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 88.1 t -61.06 -61.08 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.514 -0.766 . . . . 1.4099999999999999 111.302 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.1 ptpt -59.91 -34.74 73.6 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.088 -0.708 . . . . 0.67000000000000004 109.088 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.636 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 5.4 mm100 -64.79 -41.49 95.8 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.729 -0.669 . . . . 0.98999999999999999 110.393 176.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.779 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -67.71 -36.38 80.51 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.336 0.589 . . . . 0.41999999999999998 110.392 175.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.541 ' HB3' ' CZ ' ' A' ' 104' ' ' PHE . 1.2 mp -72.41 -24.14 61.19 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.411 -0.813 . . . . 1.3300000000000001 111.524 -178.255 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.636 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -81.31 -18.48 45.63 Favored 'General case' 0 CA--C 1.509 -0.613 0 C-N-CA 119.453 -0.899 . . . . 2.1699999999999999 109.027 178.0 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.477 ' HG3' ' HA ' ' A' ' 157' ' ' ASN . 4.3 mm-40 -80.46 -54.38 5.74 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.597 -1.183 . . . . 1.1000000000000001 109.983 175.302 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.83 -41.11 99.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.38 -0.827 . . . . 0.53000000000000003 109.907 176.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.685 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -64.04 -43.61 97.08 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.299 -0.864 . . . . 0.69999999999999996 111.413 175.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 51' ' ' ARG . 19.1 t70 -52.85 -50.11 64.42 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 122.432 0.293 . . . . 1.04 110.964 178.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.736 ' O ' ' HG2' ' A' ' 60' ' ' ARG . 41.4 mt-10 -65.32 -28.22 69.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.138 -0.483 . . . . 2.29 110.955 179.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.514 ' HE2' ' HB2' ' A' ' 102' ' ' ALA . 0.3 OUTLIER -81.09 -19.86 42.75 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.388 -0.369 . . . . 2.29 111.983 177.732 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.685 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 92.1 mt-10 -62.57 -57.07 12.44 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 122.516 -0.115 . . . . 1.3 111.15 -178.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.866 ' H ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -62.99 -31.96 73.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.727 -0.215 . . . . 1.54 111.255 179.191 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.736 ' HG2' ' O ' ' A' ' 56' ' ' GLU . 18.7 mmt180 -50.2 -52.03 39.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.231 -0.441 . . . . 2.5800000000000001 110.8 173.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.476 ' HB2' ' CZ ' ' A' ' 65' ' ' PHE . 28.9 m-85 -92.47 -3.83 54.57 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.206 -0.452 . . . . 5.3200000000000003 111.827 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.797 ' HB2' ' HA ' ' A' ' 59' ' ' LEU . 21.7 tpp180 -50.43 -50.81 51.04 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.577 0.584 . . . . 4.4800000000000004 112.577 -171.058 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 53.8 ttp180 -71.41 -16.29 62.39 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.191 0.519 . . . . 4.7199999999999998 111.084 -177.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.499 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -90.2 -38.98 13.09 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.498 0.555 . . . . 1.1699999999999999 112.498 -172.436 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.476 ' CZ ' ' HB2' ' A' ' 61' ' ' TYR . 44.8 m-85 -45.56 -46.46 14.16 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.247 0.832 . . . . 2.8100000000000001 113.247 -170.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 22.9 t -66.27 -27.14 67.71 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.086 0.47 . . . . 2.1899999999999999 111.215 -174.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -88.56 -34.49 17.34 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.497 0.665 . . . . 2.7200000000000002 109.502 176.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.709 ' O ' HD12 ' A' ' 72' ' ' LEU . 5.5 mp -66.45 -31.37 72.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.139 -0.937 . . . . 1.5600000000000001 112.595 -176.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.71 HG22 HG13 ' A' ' 74' ' ' ILE . 11.7 p -61.17 -24.23 66.16 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.109 -0.636 . . . . 0.69999999999999996 110.661 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 31.1 t -77.65 -41.02 39.75 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.824 -0.625 . . . . 1.3400000000000001 109.391 172.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.609 ' HG3' ' HA ' ' A' ' 68' ' ' LEU . 12.9 mt-30 -61.03 -49.48 77.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.369 -0.832 . . . . 1.4199999999999999 110.588 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.73 ' HB3' ' HB3' ' A' ' 82' ' ' SER . 1.2 mp -75.53 -31.33 60.06 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.63 -0.713 . . . . 1.3700000000000001 110.603 179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 48.0 m80 65.92 59.69 0.7 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.64 0.733 . . . . 2.7200000000000002 109.131 -172.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.71 HG13 HG22 ' A' ' 69' ' ' THR . 23.6 mm -59.29 112.79 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 114.4 -1.273 . . . . 0.91000000000000003 111.382 -178.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.741 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -153.07 -171.97 0.3 Allowed Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 107.781 -1.192 . . . . 0.51000000000000001 107.781 -170.029 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.741 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 21.7 Cg_exo -30.25 166.2 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.295 0 C-N-CA 124.911 3.74 . . . . 0.46999999999999997 114.935 165.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.498 ' O ' ' HD1' ' A' ' 80' ' ' TYR . . . -29.59 -30.23 0.01 OUTLIER Glycine 0 N--CA 1.472 1.058 0 N-CA-C 117.282 1.673 . . . . 0.40000000000000002 117.282 -172.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.457 ' N ' ' O ' ' A' ' 76' ' ' PRO . 32.2 p -67.87 6.12 0.75 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 118.019 0.909 . . . . 0.56000000000000005 112.157 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.57 -12.92 61.87 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 120.962 0.411 . . . . 0.34000000000000002 109.982 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.498 ' HD1' ' O ' ' A' ' 77' ' ' GLY . 5.0 p90 -78.26 -16.34 57.89 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.15 0.5 . . . . 4.1299999999999999 109.68 175.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.534 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 32.3 mt-30 -84.78 -24.51 28.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.775 0.798 . . . . 1.03 109.604 171.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.73 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 13.0 m -73.46 -52.1 14.84 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 114.566 -1.197 . . . . 0.47999999999999998 109.361 172.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.564 ' HA ' HG23 ' A' ' 86' ' ' VAL . 86.9 t80 -67.14 -17.02 64.67 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.183 -0.917 . . . . 1.1799999999999999 109.908 175.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.635 ' HA ' HG12 ' A' ' 87' ' ' VAL . 43.0 tt0 -58.54 -48.86 79.47 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 116.033 -0.531 . . . . 0.80000000000000004 110.195 174.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -47.14 -35.45 7.24 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.176 -0.92 . . . . 1.6200000000000001 110.917 174.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.76 HG13 ' HG ' ' B' 1008 ' ' LEU . 1.7 t -82.14 -49.91 16.82 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 114.534 -1.212 . . . . 1.3 110.503 -175.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.635 HG12 ' HA ' ' A' ' 84' ' ' GLU . 8.4 p -62.8 -21.35 27.54 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.133 0 O-C-N 121.494 -0.754 . . . . 0.84999999999999998 109.991 179.093 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.489 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 3.0 m-80 -78.44 -37.34 43.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.373 -1.285 . . . . 0.91000000000000003 112.475 177.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 1.104 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.3 pp20? -73.38 -29.27 62.52 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 108.904 -0.776 . . . . 2.8700000000000001 108.904 175.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.759 ' HB3' ' NH1' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -72.72 -35.82 67.65 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-N 114.549 -1.205 . . . . 1.28 111.401 -168.087 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.489 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 1.0 OUTLIER -103.87 12.91 33.85 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.136 0.493 . . . . 2.2999999999999998 110.918 -173.168 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.903 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -51.91 -43.12 63.26 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.404 -0.816 . . . . 5.0599999999999996 112.09 -178.318 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.916 ' HB3' HD21 ' A' ' 96' ' ' ASN . 14.7 t70 -74.0 -23.12 59.39 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 122.066 0.936 . . . . 3.1200000000000001 110.371 177.113 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.853 ' O ' HG23 ' A' ' 95' ' ' VAL . . . 131.03 -38.7 1.89 Allowed Glycine 0 N--CA 1.436 -1.307 0 CA-C-N 114.037 -1.438 . . . . 2.3100000000000001 110.245 177.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.853 HG23 ' O ' ' A' ' 94' ' ' GLY . 2.7 t 172.88 135.37 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.347 0.488 0 C-N-CA 126.96 2.104 . . . . 1.0600000000000001 108.388 160.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.916 HD21 ' HB3' ' A' ' 93' ' ' ASP . 2.9 m120 -111.35 147.14 35.79 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.431 -0.581 . . . . 2.1200000000000001 109.431 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.563 ' CE3' ' HA ' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -54.51 -46.49 73.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.188 0.518 . . . . 3.3399999999999999 110.581 177.437 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 1.005 ' HA3' HG12 ' B' 1015 ' ' ILE . . . -79.32 -19.57 71.49 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.925 -0.655 . . . . 0.68999999999999995 112.872 -178.412 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.831 ' HG2' ' H ' ' A' ' 96' ' ' ASN . 0.1 OUTLIER -72.45 -28.74 63.13 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.73 -0.47 . . . . 4.2400000000000002 109.73 -179.354 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 77.5 mt -65.27 -38.52 82.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 109.76 -0.459 . . . . 0.44 109.76 177.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.464 ' HA ' ' CD1' ' A' ' 104' ' ' PHE . 2.0 m -69.66 -34.69 62.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 116.134 -0.484 . . . . 1.3500000000000001 109.93 175.218 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.514 ' HB2' ' HE2' ' A' ' 57' ' ' PHE . . . -63.23 -49.34 74.52 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.558 0.694 . . . . 0.44 110.078 175.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -55.13 -49.11 72.59 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.313 -1.312 . . . . 1.49 111.715 -179.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.587 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 0.2 OUTLIER -77.27 -26.59 52.57 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.489 -0.484 . . . . 3.29 110.832 -176.336 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.696 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 29.2 t -73.55 -49.42 26.53 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.109 0.48 . . . . 1.1899999999999999 110.197 179.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.495 ' HZ ' HD11 ' A' ' 72' ' ' LEU . 29.2 t80 -71.2 -24.89 62.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.893 -0.594 . . . . 2.8900000000000001 109.802 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.403 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -68.19 -43.25 81.1 Favored Glycine 0 N--CA 1.447 -0.597 0 C-N-CA 120.804 -0.712 . . . . 0.29999999999999999 111.334 172.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.834 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -63.61 -32.41 84.08 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.77 -0.729 . . . . 0.23000000000000001 111.319 174.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.58 -30.02 61.55 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.827 0.346 . . . . 0.31 110.639 175.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.548 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -63.8 -41.18 97.96 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 107.988 -1.116 . . . . 1.1200000000000001 107.988 -179.634 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.691 ' SG ' HG22 ' A' ' 123' ' ' VAL . 25.0 t -52.58 -54.55 31.47 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.468 -1.696 . . . . 0.26000000000000001 110.904 173.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.405 HG11 ' HD3' ' A' ' 20' ' ' LYS . 68.9 t -64.37 -41.25 91.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.243 -0.435 . . . . 0.34999999999999998 111.588 -177.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.51 ' HB3' HG21 ' A' ' 74' ' ' ILE . 1.4 mm-40 -60.62 -25.03 65.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.035 0.445 . . . . 2.5099999999999998 110.746 178.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.454 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 50.6 m -77.14 -40.59 45.05 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 108.896 -0.779 . . . . 0.28000000000000003 108.896 174.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 111' ' ' CYS . 98.2 t -64.47 -35.42 74.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.095 -0.957 . . . . 1.23 109.461 -179.613 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -50.17 -50.89 47.67 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 113.582 -1.645 . . . . 0.59999999999999998 111.129 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.406 ' HB2' ' HG3' ' A' ' 119' ' ' MET . 12.8 mmtp -87.2 14.1 8.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.703 -0.68 . . . . 1.6200000000000001 110.621 -179.188 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.419 ' HA ' HE21 ' A' ' 120' ' ' GLN . 39.8 mt-10 66.1 38.34 4.8 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.443 0.639 . . . . 1.8799999999999999 110.308 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.465 ' HB3' HD23 ' A' ' 122' ' ' LEU . 24.7 mtm -117.71 50.16 1.16 Allowed 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.551 -0.907 . . . . 0.31 108.551 -178.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.419 HE21 ' HA ' ' A' ' 118' ' ' GLU . 3.6 mt-30 -65.63 -7.1 13.35 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.725 -1.125 . . . . 1.1499999999999999 112.285 -176.116 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.531 HG23 HD22 ' A' ' 122' ' ' LEU . 30.0 m -68.04 -20.54 25.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.616 0.246 . . . . 0.46000000000000002 111.349 173.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.724 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.3 mm? -76.39 -27.18 56.25 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 110.216 -0.29 . . . . 0.26000000000000001 110.216 177.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.691 HG22 ' SG ' ' A' ' 111' ' ' CYS . 56.3 t -44.69 -53.15 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 O-C-N 123.986 0.804 . . . . 0.25 112.162 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.604 ' HB3' ' HA ' ' A' ' 28' ' ' SER . 1.5 p -69.93 -39.42 76.14 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-O 120.86 0.362 . . . . 1.3500000000000001 111.587 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.724 ' HD2' HD13 ' A' ' 122' ' ' LEU . 92.2 mtt180 -62.15 -55.5 28.18 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.571 -0.74 . . . . 2.6699999999999999 110.183 -177.252 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.622 ' HA ' ' CE2' ' A' ' 129' ' ' TRP . 77.9 mt -51.93 -51.14 30.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.512 -0.767 . . . . 0.23000000000000001 111.177 -179.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.66 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -58.81 -25.57 63.29 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.804 0.298 . . . . 0.28999999999999998 111.804 -178.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.965 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -67.35 -63.88 0.97 Allowed 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.131 0.491 . . . . 0.28000000000000003 110.089 -178.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . 0.622 ' CE2' ' HA ' ' A' ' 126' ' ' ILE . 24.1 p-90 -78.1 -16.72 57.74 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 115.304 -0.862 . . . . 3.9100000000000001 112.059 -174.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.607 ' SD ' HG22 ' A' ' 126' ' ' ILE . 81.7 mtp -59.39 -54.35 47.77 Favored 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 120.144 -0.622 . . . . 1.0800000000000001 109.822 169.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.47 -38.29 77.67 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.763 -0.653 . . . . 0.25 110.689 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.606 ' HB ' ' HA ' ' A' ' 129' ' ' TRP . 56.7 m -60.92 -43.34 98.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 121.062 -0.255 . . . . 0.40000000000000002 111.378 175.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.477 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 82.7 t80 -59.71 -43.09 94.28 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.963 -0.384 . . . . 3.1299999999999999 109.963 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.717 HD13 ' HB2' ' A' ' 5' ' ' ASN . 5.4 tt -60.62 -47.62 85.42 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.734 -0.839 . . . . 0.94999999999999996 108.734 174.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . 0.441 ' OD1' ' HB2' ' A' ' 2' ' ' SER . 2.8 m-80 -48.37 -58.59 4.39 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.663 -0.699 . . . . 0.46000000000000002 112.394 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -81.39 -45.56 15.92 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.197 0.443 . . . . 0.58999999999999997 112.197 -173.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . 0.477 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 1.6 m-70 -90.64 -50.14 6.09 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 112.744 0.646 . . . . 1.45 112.744 -170.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.62 HD21 ' NH2' ' A' ' 99' ' ' ARG . 59.9 mt -89.33 -39.03 13.72 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 113.44 0.904 . . . . 1.2 113.44 -165.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.648 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 32.1 tt0 -50.81 -52.45 57.01 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-O 119.134 -0.46 . . . . 0.75 112.098 -172.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.637 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 50.1 Cg_exo -53.85 -51.71 10.11 Favored 'Trans proline' 0 C--N 1.358 1.049 0 C-N-CA 121.772 1.648 . . . . 0.56000000000000005 111.505 176.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . 0.505 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 8.4 t-105 -55.14 -51.9 64.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.186 -0.915 . . . . 1.2 110.678 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.602 HD12 ' HA ' ' A' ' 139' ' ' GLU . 59.7 mt -46.85 -53.06 3.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.884 -0.598 . . . . 0.32000000000000001 111.654 172.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.648 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 76.3 mm-40 -62.18 -29.87 70.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.085 -0.507 . . . . 0.56999999999999995 111.675 -178.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.637 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 11.6 mm-40 -63.95 -20.57 65.97 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.611 0.72 . . . . 0.78000000000000003 110.437 175.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.665 HD22 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -104.1 0.94 30.28 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.072 -0.967 . . . . 0.93000000000000005 109.019 -175.487 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 124.8 -46.24 1.1 Allowed Glycine 0 N--CA 1.441 -1.028 0 CA-C-N 114.85 -1.068 . . . . 0.56000000000000005 112.299 178.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.429 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 135.03 178.21 15.51 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.238 -0.745 . . . . 0.48999999999999999 111.238 -177.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.688 ' HB2' ' OE1' ' A' ' 42' ' ' GLU . 5.2 m-90 -63.5 -37.66 88.17 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 117.056 0.428 . . . . 3.5699999999999998 110.412 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 20.7 m-20 -52.85 -43.9 66.39 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.211 0.529 . . . . 1.96 110.203 176.243 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.574 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 89.2 m -60.24 -37.82 81.54 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.211 -0.904 . . . . 0.67000000000000004 111.95 -175.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.438 ' CE2' HD12 ' A' ' 50' ' ' LEU . 84.7 t80 -62.97 -38.46 91.19 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 120.402 -0.519 . . . . 3.0 109.989 -179.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.643 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.5 m -74.67 -24.57 18.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.222 0.534 . . . . 1.1499999999999999 109.774 178.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 36.2 mm-40 -64.35 -25.49 68.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.201 0.524 . . . . 1.6699999999999999 110.081 173.042 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.0 mt -96.03 -57.42 2.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.697 -0.683 . . . . 1.3 110.476 178.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -120.36 28.82 7.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.561 -0.745 . . . . 4.2400000000000002 111.279 -170.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.779 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -60.94 167.69 10.84 Favored Glycine 0 CA--C 1.501 -0.817 0 CA-C-N 115.576 -0.738 . . . . 1.1000000000000001 113.258 179.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.557 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 28.8 t-20 -56.65 114.94 2.26 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 113.994 -1.103 . . . . 1.29 111.49 -178.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.693 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 9.5 m120 -72.11 -27.53 62.69 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.146 0.424 . . . . 2.9900000000000002 112.146 -173.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -57.53 -38.52 74.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.206 0.527 . . . . 2.52 110.224 175.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.443 ' HB1' ' NH2' ' A' ' 164' ' ' ARG . . . -88.34 -36.75 16.44 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.818 -0.628 . . . . 2.8700000000000001 110.706 176.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.693 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -58.66 -55.97 28.22 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.209 -0.451 . . . . 3.2000000000000002 111.537 -178.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -66.6 -25.39 66.59 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.465 -0.334 . . . . 3.7200000000000002 110.958 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 23.3 t -69.74 -44.88 69.34 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.77 -0.456 . . . . 4.1799999999999997 109.77 176.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . 0.443 ' NH2' ' HB1' ' A' ' 160' ' ' ALA . 0.2 OUTLIER -68.48 -32.05 71.77 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 120.982 0.42 . . . . 5.8200000000000003 110.403 176.596 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -59.58 -38.57 81.53 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.189 -0.914 . . . . 4.7699999999999996 110.303 178.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -59.97 -47.61 90.14 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 115.657 -0.701 . . . . 5.0999999999999996 112.678 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -80.25 -21.27 42.95 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.913 0.387 . . . . 5.7199999999999998 110.793 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.405 ' O ' ' HD2' ' A' ' 172' ' ' HIS . 29.2 tt0 -70.17 -17.13 63.16 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.436 -0.579 . . . . 5.8799999999999999 109.436 175.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.42 ' O ' ' HD3' ' A' ' 169' ' ' ARG . 0.3 OUTLIER -67.05 -34.58 77.99 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.805 -0.813 . . . . 7.3399999999999999 108.805 178.89 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.419 HD13 ' HA ' ' A' ' 170' ' ' LEU . 4.0 mm? -82.54 -14.19 55.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.179 -0.919 . . . . 6.9699999999999998 110.151 178.145 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -81.22 -44.09 18.3 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.476 -0.784 . . . . 6.9699999999999998 109.627 176.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . 0.405 ' HD2' ' O ' ' A' ' 168' ' ' GLU . 57.3 m-70 -60.89 -35.29 76.27 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 116.007 -0.542 . . . . 9.3499999999999996 110.589 177.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -90.17 91.08 8.38 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.567 -0.531 . . . . 11.4 109.567 174.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 72.3 m-70 -80.34 174.66 11.38 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.054 -0.521 . . . . 11.52 110.455 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -59.66 151.31 25.18 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.084 -0.507 . . . . 14.48 110.094 175.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -63.35 140.94 58.92 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.43 -0.35 . . . . 15.369999999999999 110.208 -178.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 71.6 m80 -68.27 -43.32 78.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.334 -0.394 . . . . 16.02 110.19 179.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 92.6 mt 59.9 -175.21 0.1 Allowed 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.82 -0.627 . . . . 17.989999999999998 111.861 177.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 59.52 82.66 0.15 Allowed 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.533 -0.758 . . . . 19.190000000000001 111.44 177.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 64.3 m80 62.66 27.42 16.14 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.724 -0.671 . . . . 22.260000000000002 111.658 176.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 84.0 t60 -89.71 129.97 36.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.451 -0.341 . . . . 22.510000000000002 110.356 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -98.94 170.66 8.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.24 -0.437 . . . . 24.890000000000001 110.853 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 42.2 m80 -68.06 125.36 26.09 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.048 -0.524 . . . . 25.579999999999998 110.79 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -60.29 -30.41 69.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.951 -0.568 . . . . 27.370000000000001 110.476 177.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 46.2 t-80 . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.602 -0.713 . . . . 29.059999999999999 109.615 178.52 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.17 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -71.39 131.0 19.19 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.856 -0.687 . . . . 2.9700000000000002 112.384 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.568 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . 62.7 m 61.2 -120.65 0.8 Allowed 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 122.357 0.263 . . . . 1.9399999999999999 110.905 -179.118 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.959 HG23 ' H ' ' B' 1005 ' ' GLY . 30.4 m 40.22 -88.89 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 125.151 1.38 . . . . 1.6299999999999999 113.902 174.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 0.959 ' H ' HG23 ' B' 1004 ' ' VAL . . . -38.73 -33.7 0.23 Allowed Glycine 0 CA--C 1.529 0.918 0 CA-C-N 118.505 0.593 . . . . 1.2 113.416 169.338 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . 0.548 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 6.4 mpt_? -83.3 -56.86 3.52 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.003 0.43 . . . . 2.8799999999999999 111.133 174.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . 0.653 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -67.83 -54.98 14.74 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.895 0.702 . . . . 1.3100000000000001 112.895 -169.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.76 ' HG ' HG13 ' A' ' 86' ' ' VAL . 3.0 mm? -58.44 -53.64 56.01 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.227 0.329 . . . . 1.3300000000000001 110.965 -175.378 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 1.104 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -47.65 -45.74 28.29 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.701 0.762 . . . . 0.88 110.848 176.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.789 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -67.12 -54.45 21.23 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 114.303 -1.317 . . . . 1.03 111.406 -177.086 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.601 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 58.7 m-85 -66.71 -17.1 64.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.066 -0.516 . . . . 1.6699999999999999 110.528 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -83.94 -3.99 88.85 Favored Glycine 0 N--CA 1.445 -0.76 0 CA-C-N 115.863 -0.608 . . . . 0.78000000000000003 113.467 -176.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.4 t70 -93.56 3.9 54.8 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.645 0.736 . . . . 1.8999999999999999 109.796 176.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 34.4 m -97.14 28.25 3.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.668 -0.696 . . . . 1.4399999999999999 111.687 -175.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 1.005 HG12 ' HA3' ' A' ' 98' ' ' GLY . 0.5 OUTLIER -76.22 72.32 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.988 0.423 . . . . 2.9100000000000001 110.797 176.399 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 15.8 m120 -128.32 131.8 48.64 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.836 -0.62 . . . . 4.29 110.03 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -116.41 86.01 2.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.304 -0.407 . . . . 8.1699999999999999 110.49 -176.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.634 0 CA-C-N 116.523 -0.308 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.789 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 110.081 -0.34 . . . . 6.21 110.081 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.9 p 49.31 27.85 2.06 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.766 0.826 . . . . 1.8700000000000001 112.88 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.428 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 42.1 tp60 -90.81 0.81 57.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.682 0.753 . . . . 2.4199999999999999 109.546 179.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.446 ' CB ' ' HG2' ' A' ' 42' ' ' GLU . 0.9 OUTLIER -72.78 -3.97 28.65 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.097 -0.956 . . . . 1.25 110.852 -178.427 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.554 ' HB2' ' HG ' ' A' ' 134' ' ' LEU . 3.3 p30 -62.97 -26.66 68.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.986 -0.552 . . . . 1.78 111.218 177.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.829 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.9 tpp180 -51.52 -49.87 61.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.05 -0.523 . . . . 1.3999999999999999 110.506 173.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.813 ' HB3' ' HE3' ' A' ' 47' ' ' LYS . 53.1 mt-10 -50.49 -52.74 35.56 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.964 -1.017 . . . . 0.68000000000000005 112.066 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.65 HD11 HG22 ' A' ' 46' ' ' VAL . 1.2 mp -50.71 -31.47 16.59 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.913 0.885 . . . . 1.1599999999999999 112.094 -177.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.482 HG13 ' HE2' ' A' ' 130' ' ' MET . 96.3 t -80.35 -60.35 2.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-O 121.48 0.657 . . . . 0.27000000000000002 110.023 174.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 6' ' ' ARG . 46.4 t -53.37 -54.2 19.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 114.79 -1.095 . . . . 0.33000000000000002 112.755 -174.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -57.25 -36.53 71.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.128 0.489 . . . . 0.58999999999999997 110.316 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.704 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -66.31 -53.54 35.33 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.633 -0.712 . . . . 1.6100000000000001 109.985 179.246 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 1.015 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.7 mp -60.68 -38.5 85.15 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-O 120.699 0.285 . . . . 0.34000000000000002 110.827 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.515 ' HA ' ' CB ' ' A' ' 24' ' ' TRP . 27.0 t -60.67 -37.05 80.27 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.17 0.51 . . . . 1.05 110.677 177.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -77.07 -23.81 51.92 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.975 -0.557 . . . . 1.22 110.252 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.795 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 8.8 mmpt? -81.67 -39.94 23.6 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.281 -0.418 . . . . 1.4099999999999999 111.648 -177.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.593 HD23 ' HA ' ' A' ' 24' ' ' TRP . 0.2 OUTLIER -61.99 -27.84 69.15 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 119.926 -0.709 . . . . 1.3500000000000001 110.183 176.294 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 5.7 t -75.04 -13.9 60.54 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.526 -0.761 . . . . 0.93999999999999995 111.337 -177.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.795 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 20.7 pt20 -81.01 -9.39 59.85 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-O 121.388 0.613 . . . . 1.3700000000000001 111.883 -177.28 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.802 ' HZ3' HG13 ' A' ' 112' ' ' VAL . 0.0 OUTLIER -120.02 -20.3 7.52 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 122.048 0.928 . . . . 2.2000000000000002 109.646 178.828 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.65 29.98 5.4 Favored Glycine 0 C--N 1.305 -1.18 0 CA-C-N 113.869 -1.514 . . . . 0.53000000000000003 112.799 175.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -109.82 169.69 8.55 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.715 0.293 . . . . 0.76000000000000001 110.909 168.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.5 t -105.27 150.19 25.36 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.153 0.501 . . . . 0.52000000000000002 110.843 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.593 ' HA ' HD23 ' A' ' 17' ' ' LEU . 0.0 OUTLIER -81.11 -43.79 18.91 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.346 -0.843 . . . . 3.3599999999999999 110.032 172.88 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.452 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 7.0 p -71.21 -23.51 62.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.971 -0.559 . . . . 1.3700000000000001 111.564 -172.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -65.15 -27.26 68.6 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.902 0.382 . . . . 1.1100000000000001 110.966 175.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -122.28 16.56 10.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.05 -0.523 . . . . 1.28 112.21 -174.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.452 ' OG ' ' HA ' ' A' ' 25' ' ' SER . 90.2 p -100.61 -179.23 4.03 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.88 0.696 . . . . 1.8100000000000001 112.88 -172.822 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.544 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 1.9 t70 -168.59 -24.19 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.324 -1.307 . . . . 2.3100000000000001 109.806 178.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.832 HG23 ' H ' ' A' ' 31' ' ' GLU . 9.2 m -47.48 -70.95 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 114.912 -1.04 . . . . 0.92000000000000004 113.08 -171.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.832 ' H ' HG23 ' A' ' 30' ' ' VAL . 9.3 pt-20 -100.82 2.43 41.09 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.721 0.772 . . . . 2.7400000000000002 109.054 175.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.544 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 29.5 tt0 -70.59 -59.02 3.07 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 114.624 -1.171 . . . . 1.45 111.127 -177.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.413 HD22 ' HA ' ' A' ' 29' ' ' ASP . 48.2 m-80 -94.18 -41.62 9.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.981 -0.554 . . . . 1.8700000000000001 111.038 -173.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.527 ' HG2' ' O ' ' A' ' 30' ' ' VAL . 9.4 ptp180 -96.75 152.13 18.97 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.472 -0.566 . . . . 3.3900000000000001 109.472 177.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.5 p -128.68 104.23 7.53 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-O 121.665 0.745 . . . . 2.25 111.028 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -104.98 -75.72 0.62 Allowed 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.913 -1.04 . . . . 3.3399999999999999 108.927 -178.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.428 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . . . -100.71 153.9 37.47 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.435 -0.802 . . . . 1.9199999999999999 109.672 173.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.732 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 54.0 Cg_exo -52.93 162.39 2.65 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 C-N-CA 122.848 2.365 . . . . 1.8700000000000001 112.581 173.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -76.92 1.31 18.02 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.315 -0.402 . . . . 4.6399999999999997 111.048 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.729 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 179.18 66.93 0.07 OUTLIER Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 121.028 -0.606 . . . . 2.1499999999999999 112.025 177.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.802 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.5 t -90.03 -76.02 0.44 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 120.351 -0.54 . . . . 1.1200000000000001 111.482 -177.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.802 ' H ' HG23 ' A' ' 41' ' ' THR . 11.9 pt-20 -94.56 -30.58 14.3 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-O 122.152 0.977 . . . . 2.02 110.376 176.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.932 ' HA ' HG13 ' A' ' 46' ' ' VAL . 58.5 m -75.66 -17.85 59.84 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 113.725 -1.58 . . . . 1.25 114.372 -166.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.583 ' HA ' ' CD ' ' A' ' 47' ' ' LYS . 39.4 tt0 -45.68 -47.02 15.09 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 118.237 0.471 . . . . 1.9099999999999999 111.113 -177.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.64 -46.03 64.06 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.721 0.267 . . . . 0.52000000000000002 111.721 175.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.932 HG13 ' HA ' ' A' ' 43' ' ' SER . 1.9 m -67.1 -35.47 74.47 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 120.946 0.403 . . . . 1.4099999999999999 111.309 -175.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.813 ' HE3' ' HB3' ' A' ' 7' ' ' GLU . 6.8 ptmt -77.66 -32.29 53.13 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.963 -0.754 . . . . 0.67000000000000004 108.963 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.735 ' NE2' ' HD2' ' A' ' 51' ' ' ARG . 0.0 OUTLIER -66.08 -30.47 70.99 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.719 -0.673 . . . . 0.98999999999999999 110.131 173.512 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.641 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -76.95 -42.66 38.3 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.233 0.54 . . . . 0.41999999999999998 111.077 176.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.561 HD21 ' HD2' ' A' ' 104' ' ' PHE . 1.3 tp -66.29 -25.1 66.7 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.621 -0.718 . . . . 1.3300000000000001 112.486 -173.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.735 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.9 ptp180 -81.33 -28.42 34.55 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 109.069 -0.715 . . . . 2.1699999999999999 109.069 -175.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 48' ' ' GLN . 10.8 mm-40 -74.2 -49.17 24.6 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.546 -1.206 . . . . 1.1000000000000001 109.38 176.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.65 -39.35 88.01 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.483 -0.78 . . . . 0.53000000000000003 110.092 174.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.67 ' HA3' ' HZ ' ' A' ' 12' ' ' PHE . . . -63.91 -43.88 96.87 Favored Glycine 0 N--CA 1.446 -0.697 0 CA-C-N 115.59 -0.732 . . . . 0.69999999999999996 112.047 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.615 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 32.6 t70 -58.14 -43.74 87.47 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.691 0.281 . . . . 1.04 110.256 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 52' ' ' GLU . 78.0 mm-40 -58.19 -28.3 64.67 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.687 -0.688 . . . . 2.29 111.381 177.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -81.69 -44.54 16.98 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.919 -0.582 . . . . 2.29 110.83 176.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.654 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 37.4 mt-10 -61.96 -63.2 1.33 Allowed 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.833 -0.621 . . . . 1.3 112.007 -172.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.713 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -48.9 -34.25 12.35 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.999 0.74 . . . . 1.54 112.999 -173.738 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.713 ' H ' HD12 ' A' ' 59' ' ' LEU . 71.5 mtt-85 -62.88 -61.6 2.29 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.109 0.481 . . . . 2.5800000000000001 111.45 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -92.05 -3.61 55.55 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.827 -0.624 . . . . 5.3200000000000003 112.073 -173.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -49.93 -29.58 8.62 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 113.047 0.758 . . . . 4.4800000000000004 113.047 -175.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.9 mtp180 -54.32 -34.08 60.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.799 0.333 . . . . 4.7199999999999998 111.741 177.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.641 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -88.72 -26.6 21.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.491 -0.322 . . . . 1.1699999999999999 111.418 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.605 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 39.0 t80 -46.83 -45.99 20.52 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.557 0.577 . . . . 2.8100000000000001 112.557 -173.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 10.4 p -69.0 -24.92 64.28 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.848 0.356 . . . . 2.1899999999999999 111.629 -175.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -90.57 -29.77 17.63 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.482 -0.326 . . . . 2.7200000000000002 111.182 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.665 ' O ' HD12 ' A' ' 72' ' ' LEU . 18.8 mt -61.55 -22.77 65.46 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 112.589 0.589 . . . . 1.5600000000000001 112.589 -173.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.624 HG22 HG13 ' A' ' 74' ' ' ILE . 15.8 p -58.68 -23.31 59.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.033 0.444 . . . . 0.69999999999999996 110.956 178.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 7.6 t -77.66 -38.99 46.49 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.903 -0.59 . . . . 1.3400000000000001 109.64 176.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.52 ' NE2' HD22 ' A' ' 68' ' ' LEU . 12.4 mt-30 -65.15 -54.45 29.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.691 -0.686 . . . . 1.4199999999999999 109.837 179.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.665 HD12 ' O ' ' A' ' 68' ' ' LEU . 1.2 mp -66.36 -30.48 70.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.452 -0.794 . . . . 1.3700000000000001 110.129 179.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 50.1 t-80 63.71 59.83 1.13 Allowed 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 122.167 0.984 . . . . 2.7200000000000002 108.474 -175.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.624 HG13 HG22 ' A' ' 69' ' ' THR . 17.2 mm -57.82 122.96 8.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 113.789 -1.55 . . . . 0.91000000000000003 111.01 -178.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.749 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -157.34 -172.82 0.34 Allowed Pre-proline 0 CA--C 1.548 0.893 0 N-CA-C 108.021 -1.104 . . . . 0.51000000000000001 108.021 -168.825 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.749 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 34.9 Cg_exo -29.63 165.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 125.119 3.879 . . . . 0.46999999999999997 115.266 165.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.435 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -29.56 -29.9 0.01 OUTLIER Glycine 0 N--CA 1.473 1.151 0 N-CA-C 117.33 1.692 . . . . 0.40000000000000002 117.33 -174.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.441 ' N ' ' O ' ' A' ' 76' ' ' PRO . 39.4 p -71.66 11.08 0.54 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 117.79 0.795 . . . . 0.56000000000000005 111.938 179.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.01 -13.17 61.91 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.246 0.546 . . . . 0.34000000000000002 109.736 172.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -78.79 -14.57 59.19 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.173 -0.677 . . . . 4.1299999999999999 109.173 175.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.433 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 53.5 mt-30 -84.52 -20.87 30.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.828 0.823 . . . . 1.03 109.917 172.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.595 ' HB3' ' HB3' ' A' ' 72' ' ' LEU . 6.5 m -80.02 -48.64 12.99 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 114.575 -1.193 . . . . 0.47999999999999998 108.828 169.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -62.75 -17.43 60.92 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.887 -1.051 . . . . 1.1799999999999999 109.915 174.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.645 ' HA ' HG12 ' A' ' 87' ' ' VAL . 34.7 tt0 -60.49 -50.44 73.53 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.458 -0.792 . . . . 0.80000000000000004 110.579 177.437 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -47.47 -35.14 8.22 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.01 -0.995 . . . . 1.6200000000000001 110.702 176.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.643 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 1.6 t -81.83 -51.38 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.978 0 CA-C-N 114.485 -1.234 . . . . 1.3 110.7 -177.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.645 HG12 ' HA ' ' A' ' 84' ' ' GLU . 7.8 p -61.58 -23.9 32.22 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-O 121.554 0.692 . . . . 0.84999999999999998 109.731 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.427 ' HA ' ' CE1' ' A' ' 91' ' ' PHE . 1.8 m-80 -71.99 -40.74 68.34 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.402 -1.272 . . . . 0.91000000000000003 111.977 176.433 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 1.03 ' HB2' ' HB2' ' B' 1009 ' ' ALA . 1.3 pp20? -73.23 -29.43 62.78 Favored 'General case' 0 CA--C 1.495 -1.149 0 CA-C-O 121.699 0.761 . . . . 2.8700000000000001 109.127 177.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.691 ' HG ' ' HD3' ' A' ' 99' ' ' ARG . 0.1 OUTLIER -71.05 -32.52 69.27 Favored 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.556 -1.202 . . . . 1.28 111.619 -168.158 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.427 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 2.3 p90 -107.47 11.69 28.59 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.108 0.48 . . . . 2.2999999999999998 110.859 -172.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.911 ' HD2' ' O ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -54.42 -34.53 61.53 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.685 -0.689 . . . . 5.0599999999999996 112.553 -177.789 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.998 ' HB3' HD21 ' A' ' 96' ' ' ASN . 15.4 t70 -84.48 -18.76 34.8 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 122.101 0.953 . . . . 3.1200000000000001 110.239 176.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.866 ' O ' HG23 ' A' ' 95' ' ' VAL . . . 130.95 -40.0 1.71 Allowed Glycine 0 N--CA 1.44 -1.037 0 CA-C-N 114.234 -1.348 . . . . 2.3100000000000001 110.918 173.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.866 HG23 ' O ' ' A' ' 94' ' ' GLY . 2.9 t 173.36 110.98 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.349 0.566 0 C-N-CA 127.022 2.129 . . . . 1.0600000000000001 108.15 160.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.998 HD21 ' HB3' ' A' ' 93' ' ' ASP . 1.1 m120 -83.91 152.83 24.3 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.753 -0.462 . . . . 2.1200000000000001 109.753 -177.023 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.54 ' HH2' ' HB2' ' A' ' 155' ' ' TYR . 84.9 t90 -59.04 -52.84 64.03 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.272 0.558 . . . . 3.3399999999999999 110.111 178.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 1.055 ' HA3' HG12 ' B' 1015 ' ' ILE . . . -77.41 -16.34 80.5 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.646 -0.706 . . . . 0.68999999999999995 112.698 -177.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.805 ' HB3' ' HB2' ' A' ' 96' ' ' ASN . 0.0 OUTLIER -72.51 -29.26 63.45 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.535 -0.542 . . . . 4.2400000000000002 109.535 -179.635 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 33.0 mt -63.3 -45.11 99.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 N-CA-C 109.394 -0.595 . . . . 0.44 109.394 177.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.436 HG13 ' HA2' ' A' ' 98' ' ' GLY . 1.8 m -62.6 -39.33 84.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.827 -0.624 . . . . 1.3500000000000001 109.648 175.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.24 -44.86 94.02 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 121.087 0.47 . . . . 0.44 111.04 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -58.66 -42.06 87.55 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.289 -0.869 . . . . 1.49 110.956 -179.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.651 ' HZ ' ' HB2' ' A' ' 134' ' ' LEU . 28.9 m-85 -80.63 -30.18 36.71 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.671 0.272 . . . . 3.29 111.145 179.229 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.59 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 48.0 t -63.65 -56.23 17.35 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.153 -0.476 . . . . 1.1899999999999999 110.222 176.003 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.448 ' HA ' ' HB3' ' A' ' 109' ' ' ALA . 32.7 t80 -74.31 -26.34 60.11 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.928 -0.578 . . . . 2.8900000000000001 110.364 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -65.99 -45.59 86.68 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.336 -0.935 . . . . 0.29999999999999999 111.016 173.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 1.015 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.5 -29.42 74.78 Favored Glycine 0 N--CA 1.444 -0.769 0 N-CA-C 111.11 -0.796 . . . . 0.23000000000000001 111.11 174.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.605 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -71.51 -34.54 70.19 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 109.983 -0.377 . . . . 0.31 109.983 176.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.486 ' HA ' ' OE2' ' A' ' 113' ' ' GLU . 0.3 OUTLIER -67.55 -34.88 77.97 Favored 'General case' 0 CA--C 1.506 -0.741 0 CA-C-O 121.892 0.853 . . . . 1.1200000000000001 109.781 -179.267 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.698 ' SG ' HG13 ' A' ' 123' ' ' VAL . 44.2 t -51.25 -50.73 58.65 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.295 -1.321 . . . . 0.26000000000000001 109.271 170.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.802 HG13 ' HZ3' ' A' ' 20' ' ' LYS . 86.3 t -63.84 -38.19 81.69 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 CA-C-N 116.252 -0.431 . . . . 0.34999999999999998 110.514 175.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.489 ' HB3' HG13 ' A' ' 74' ' ' ILE . 42.8 mt-10 -56.12 -33.19 64.91 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.977 0.418 . . . . 2.5099999999999998 110.552 176.168 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.461 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 25.1 m -79.73 -41.65 26.24 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.006 -0.543 . . . . 0.28000000000000003 109.557 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 111' ' ' CYS . 99.3 t -68.74 -31.01 49.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.827 0.822 . . . . 1.23 109.739 -175.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -55.61 -47.9 75.8 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.015 -1.448 . . . . 0.59999999999999998 110.858 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 23.8 mmtt -90.2 14.42 12.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.678 -0.692 . . . . 1.6200000000000001 110.325 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 62.25 43.78 8.16 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 121.74 0.781 . . . . 1.8799999999999999 111.278 -179.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.465 ' HB3' HD23 ' A' ' 122' ' ' LEU . 32.8 mtm -115.96 49.33 1.12 Allowed 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 107.645 -1.242 . . . . 0.31 107.645 178.616 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.432 ' CD ' ' H ' ' A' ' 120' ' ' GLN . 6.4 mp0 -67.85 -6.72 22.97 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.182 -1.372 . . . . 1.1499999999999999 112.455 -171.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.469 ' O ' ' HG3' ' A' ' 125' ' ' ARG . 27.0 m -72.52 -12.79 16.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.935 0.398 . . . . 0.46000000000000002 111.211 175.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.71 HD13 ' HD3' ' A' ' 125' ' ' ARG . 2.9 mm? -83.62 -24.09 31.58 Favored 'General case' 0 CA--C 1.51 -0.576 0 N-CA-C 109.776 -0.453 . . . . 0.26000000000000001 109.776 176.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.698 HG13 ' SG ' ' A' ' 111' ' ' CYS . 67.4 t -46.9 -55.58 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.783 -0.644 . . . . 0.25 112.223 -178.31 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 12.8 t -73.88 -31.41 63.13 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.729 -0.388 . . . . 1.3500000000000001 110.142 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.71 ' HD3' HD13 ' A' ' 122' ' ' LEU . 11.8 mtp180 -61.23 -58.66 7.37 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 120.859 0.362 . . . . 2.6699999999999999 110.639 178.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.661 HG22 ' SD ' ' A' ' 130' ' ' MET . 71.2 mt -51.77 -52.62 21.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.545 -0.752 . . . . 0.23000000000000001 110.043 179.257 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.802 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.19 -36.31 68.23 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 120.945 0.402 . . . . 0.28999999999999998 111.627 179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.829 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -63.59 -59.64 4.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.219 0.533 . . . . 0.28000000000000003 110.499 176.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 68.7 m95 -67.36 -22.74 65.56 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.887 -1.051 . . . . 3.9100000000000001 111.504 -174.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.661 ' SD ' HG22 ' A' ' 126' ' ' ILE . 85.9 mtp -69.24 -54.11 16.44 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.679 0.276 . . . . 1.0800000000000001 111.244 175.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.456 ' N ' HG21 ' A' ' 9' ' ' VAL . . . -67.11 -33.17 74.89 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.506 -0.316 . . . . 0.25 110.844 -177.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 97.6 m -63.8 -45.14 91.04 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.672 -0.411 . . . . 0.40000000000000002 110.884 175.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -57.91 -41.97 83.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.034 0.445 . . . . 3.1299999999999999 110.04 176.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.94 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.5 OUTLIER -57.38 -58.11 9.69 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.728 -0.669 . . . . 0.94999999999999996 109.663 172.242 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -45.22 -55.28 5.98 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.036 -0.984 . . . . 0.46000000000000002 112.631 177.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -76.21 -53.33 8.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.994 0.426 . . . . 0.58999999999999997 111.853 -173.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.79 -50.27 5.83 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.774 0.657 . . . . 1.45 112.774 -169.241 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.94 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.2 OUTLIER -76.55 -47.35 22.88 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 113.629 0.974 . . . . 1.2 113.629 -167.453 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.594 ' HA ' HD12 ' A' ' 142' ' ' ILE . 18.7 tt0 -45.24 -52.36 21.4 Favored Pre-proline 0 CA--C 1.538 0.511 0 O-C-N 123.965 0.791 . . . . 0.75 112.785 -170.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.555 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 31.3 Cg_exo -58.52 -45.21 31.52 Favored 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 121.704 1.603 . . . . 0.56000000000000005 111.689 178.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . 0.679 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.8 OUTLIER -58.78 -52.07 67.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.174 -0.921 . . . . 1.2 110.846 179.137 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.595 HD13 ' NE1' ' A' ' 148' ' ' TRP . 59.1 mt -45.62 -52.52 2.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.661 -0.7 . . . . 0.32000000000000001 111.768 175.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.573 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.7 mm-40 -58.32 -34.44 70.6 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.812 -0.631 . . . . 0.56999999999999995 111.34 -179.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 10.8 mm-40 -64.03 -22.9 67.12 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.118 0.485 . . . . 0.78000000000000003 111.103 177.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.643 HD22 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -100.9 -7.45 23.45 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.655 -0.702 . . . . 0.93000000000000005 109.575 -173.554 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 134.99 -36.96 2.0 Allowed Glycine 0 N--CA 1.44 -1.034 0 CA-C-N 115.358 -0.837 . . . . 0.56000000000000005 112.772 176.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 120.16 175.22 15.55 Favored Glycine 0 N--CA 1.449 -0.44 0 N-CA-C 111.146 -0.781 . . . . 0.48999999999999999 111.146 -175.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.595 ' NE1' HD13 ' A' ' 142' ' ' ILE . 4.8 m-90 -67.48 -33.72 75.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.339 0.569 . . . . 3.5699999999999998 111.319 -176.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.413 ' O ' ' HG3' ' A' ' 153' ' ' GLU . 9.7 m-20 -58.98 -40.06 83.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.119 0.485 . . . . 1.96 110.233 177.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.536 ' O ' ' HB2' ' A' ' 153' ' ' GLU . 55.3 m -55.54 -37.33 67.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.392 -0.822 . . . . 0.67000000000000004 112.224 177.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.425 ' HA ' ' HZ2' ' A' ' 97' ' ' TRP . 10.5 m-85 -61.47 -39.84 92.36 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.459 -0.497 . . . . 3.0 110.356 -178.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.755 HG12 ' HA ' ' A' ' 46' ' ' VAL . 0.8 OUTLIER -75.42 -26.11 18.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.074 -0.512 . . . . 1.1499999999999999 110.004 177.764 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.536 ' HB2' ' O ' ' A' ' 150' ' ' THR . 70.2 mt-10 -58.08 -30.35 66.15 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.243 -0.435 . . . . 1.6699999999999999 110.483 171.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.53 HD12 ' CE2' ' A' ' 97' ' ' TRP . 3.4 mt -98.65 -56.7 2.38 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.23 -0.441 . . . . 1.3 111.023 -176.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . 0.541 ' OH ' ' HA ' ' B' 1016 ' ' ASN . 3.1 m-85 -120.59 28.47 7.96 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.174 -0.466 . . . . 4.2400000000000002 111.098 -173.528 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.641 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -62.9 157.49 38.9 Favored Glycine 0 CA--C 1.498 -0.997 0 C-N-CA 120.654 -0.784 . . . . 1.1000000000000001 112.699 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.611 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 20.1 t-20 -54.18 113.88 1.41 Allowed 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 114.286 -0.957 . . . . 1.29 109.449 174.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.654 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 0.2 OUTLIER -91.8 2.61 56.39 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.725 -0.39 . . . . 2.9900000000000002 111.441 -171.863 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -53.27 -42.5 66.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.65 0.262 . . . . 2.52 111.067 -178.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.573 ' O ' ' HD3' ' A' ' 164' ' ' ARG . . . -69.85 -38.97 76.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.46 -0.336 . . . . 2.8700000000000001 110.891 176.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -54.21 -60.88 2.75 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.062 -0.517 . . . . 3.2000000000000002 111.11 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.654 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 5.1 pt-20 -63.67 -33.73 76.27 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.72 -0.673 . . . . 3.7200000000000002 111.651 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . 0.509 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 29.7 t -61.32 -46.26 91.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.102 0.477 . . . . 4.1799999999999997 110.32 178.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . 0.666 ' HA ' HE21 ' A' ' 167' ' ' GLN . 9.2 mpt_? -79.24 -11.34 59.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.113 -0.494 . . . . 5.8200000000000003 110.551 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -84.49 -45.5 12.58 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.828 -0.624 . . . . 4.7699999999999996 110.32 179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -64.41 -44.13 95.78 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.817 -0.629 . . . . 5.0999999999999996 112.488 -179.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.666 HE21 ' HA ' ' A' ' 164' ' ' ARG . 26.3 pt20 -75.17 -15.18 60.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.944 0.402 . . . . 5.7199999999999998 111.007 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.581 ' HB2' ' O ' ' A' ' 164' ' ' ARG . 29.2 tt0 -74.02 -10.04 59.23 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.424 0.63 . . . . 5.8799999999999999 109.662 177.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.435 ' O ' ' HD3' ' A' ' 169' ' ' ARG . 1.6 tmt_? -69.0 -37.08 78.51 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.831 -0.803 . . . . 7.3399999999999999 108.831 174.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.454 HD22 ' HA ' ' A' ' 170' ' ' LEU . 0.3 OUTLIER -89.29 -46.2 8.94 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.699 -0.682 . . . . 6.9699999999999998 109.199 177.497 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -73.98 92.1 2.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.861 -0.609 . . . . 6.9699999999999998 109.527 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -68.69 156.11 38.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.087 -0.506 . . . . 9.3499999999999996 111.034 -175.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -69.23 103.06 1.84 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.908 -0.587 . . . . 11.4 110.439 -177.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -85.8 -20.81 28.63 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.769 -0.65 . . . . 11.52 110.8 -177.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 11.8 m170 -73.69 123.65 24.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.168 0.508 . . . . 14.48 111.2 -176.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 28.8 t60 -80.8 112.66 18.39 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.463 -0.789 . . . . 15.369999999999999 109.515 178.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -87.18 122.0 30.38 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.978 -0.379 . . . . 16.02 109.978 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 55.8 tp -74.88 123.76 25.65 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.146 -0.479 . . . . 17.989999999999998 110.392 -178.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -113.4 159.16 19.75 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.394 -0.366 . . . . 19.190000000000001 110.338 177.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 16.0 p80 -69.49 133.22 47.43 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.127 0.489 . . . . 22.260000000000002 110.978 -177.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 29.2 m80 -98.98 -37.59 9.32 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.458 -0.941 . . . . 22.510000000000002 108.458 175.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -133.41 -69.52 0.55 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.95 -1.023 . . . . 24.890000000000001 109.042 171.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -167.64 127.53 1.38 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.628 -0.715 . . . . 25.579999999999998 109.843 176.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 32.7 m80 -88.83 137.94 31.86 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 110.159 -0.312 . . . . 27.370000000000001 110.159 179.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.6 m80 . . . . . 0 C--O 1.247 0.933 0 O-C-N 123.818 0.699 . . . . 29.059999999999999 110.241 -176.979 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.202 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -147.78 150.88 23.16 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.883 -0.675 . . . . 2.9700000000000002 112.248 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.422 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . 18.7 m 56.2 -143.26 0.73 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 122.86 0.464 . . . . 1.9399999999999999 110.88 -178.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.935 HG23 ' H ' ' B' 1005 ' ' GLY . 34.1 m 43.15 -92.16 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 124.815 1.246 . . . . 1.6299999999999999 113.522 176.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 1.008 ' HA2' ' HB3' ' A' ' 89' ' ' GLU . . . -41.19 -31.6 0.56 Allowed Glycine 0 CA--C 1.534 1.223 0 CA-C-N 119.034 0.834 . . . . 1.2 113.588 168.143 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . 0.407 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 8.9 mpt_? -86.23 -52.32 5.72 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.462 -0.434 . . . . 2.8799999999999999 111.344 171.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . 0.502 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -71.38 -55.02 8.79 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 113.012 0.745 . . . . 1.3100000000000001 113.012 -170.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.701 HD23 ' HA ' ' B' 1004 ' ' VAL . 3.3 mm? -59.75 -56.52 20.79 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.584 -0.28 . . . . 1.3300000000000001 110.679 -177.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 1.03 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -41.18 -48.83 3.51 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 123.899 0.749 . . . . 0.88 111.578 173.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.802 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -65.19 -55.22 19.82 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 114.427 -1.26 . . . . 1.03 111.786 -177.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.633 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 49.7 m-85 -66.05 -24.92 66.83 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.024 0.44 . . . . 1.6699999999999999 110.945 -178.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.44 -5.27 72.17 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.807 -0.633 . . . . 0.78000000000000003 113.07 -179.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 21.7 t70 -80.3 -20.73 43.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.264 0.554 . . . . 1.8999999999999999 110.114 175.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 9.7 m -85.15 34.4 0.56 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.89 -0.595 . . . . 1.4399999999999999 112.121 -172.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 1.055 HG12 ' HA3' ' A' ' 98' ' ' GLY . 1.3 pp -84.47 23.15 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 N-CA-C 112.311 0.485 . . . . 2.9100000000000001 112.311 179.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . 0.653 HD22 HD12 ' B' 1015 ' ' ILE . 9.8 p30 -161.35 -42.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 O-C-N 122.265 -0.272 . . . . 4.29 111.49 176.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . 0.402 HH11 ' HD3' ' B' 1017 ' ' ARG . 12.5 ttm180 -125.09 -86.8 0.62 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.764 0.316 . . . . 8.1699999999999999 110.459 -178.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.434 0 O-C-N 122.381 -0.199 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.802 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.5 mtm . . . . . 0 N--CA 1.481 1.079 0 N-CA-C 110.426 -0.213 . . . . 6.21 110.426 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.9 m 54.59 54.13 9.7 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.405 0.621 . . . . 1.8700000000000001 111.185 -179.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.418 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 70.4 mm-40 -70.15 -9.48 55.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.674 -0.694 . . . . 2.4199999999999999 111.141 -178.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.8 p -66.55 -18.99 65.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.107 -0.497 . . . . 1.25 111.473 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.656 ' HA ' HD22 ' A' ' 8' ' ' LEU . 72.7 m-20 -64.27 -23.92 67.48 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.072 0.463 . . . . 1.78 110.19 176.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.969 HH12 ' HA ' ' A' ' 128' ' ' ALA . 22.2 tpp180 -56.88 -55.49 33.78 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.512 -0.767 . . . . 1.3999999999999999 110.143 175.336 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.658 ' HB3' ' CE ' ' A' ' 47' ' ' LYS . 43.8 mt-10 -53.58 -49.93 66.69 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.409 -1.269 . . . . 0.68000000000000005 111.434 -177.293 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.656 HD22 ' HA ' ' A' ' 5' ' ' ASN . 0.4 OUTLIER -51.91 -33.96 39.38 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 114.963 -1.017 . . . . 1.1599999999999999 112.12 178.531 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.545 HG22 ' HE1' ' A' ' 104' ' ' PHE . 64.5 t -78.6 -59.35 3.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.719 0.771 . . . . 0.27000000000000002 109.485 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.49 HG13 ' CE2' ' A' ' 24' ' ' TRP . 73.3 t -48.32 -57.32 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 CA-C-N 114.223 -1.353 . . . . 0.33000000000000002 113.099 -176.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -59.03 -31.77 69.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.698 0.285 . . . . 0.58999999999999997 110.721 -175.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.607 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.6 t80 -75.97 -44.62 38.94 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 116.265 -0.425 . . . . 1.6100000000000001 110.444 -179.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.908 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 6.3 mp -60.43 -42.29 95.76 Favored 'General case' 0 CA--C 1.52 -0.185 0 C-N-CA 120.377 -0.529 . . . . 0.34000000000000002 110.363 176.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.437 ' HA ' HD12 ' A' ' 17' ' ' LEU . 15.8 t -62.13 -40.2 95.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.097 -0.501 . . . . 1.05 109.89 177.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -59.71 -29.84 68.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.601 -0.727 . . . . 1.22 110.769 178.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.572 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 17.4 mmmt -78.6 -50.62 11.19 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.558 0.694 . . . . 1.4099999999999999 110.506 -179.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.602 HD21 ' SG ' ' A' ' 111' ' ' CYS . 12.5 mt -56.52 -28.03 58.94 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 115.444 -0.798 . . . . 1.3500000000000001 111.853 176.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 66.7 m -56.29 -44.67 80.06 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 112.362 0.504 . . . . 0.93999999999999995 112.362 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 16' ' ' LYS . 14.8 pt20 -75.46 0.12 18.23 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.31 0.576 . . . . 1.3700000000000001 111.368 -178.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.5 ' HE2' ' CG1' ' A' ' 112' ' ' VAL . 19.6 mmmt -109.53 -30.08 8.1 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.769 0.795 . . . . 2.2000000000000002 109.199 -179.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.99 24.06 9.35 Favored Glycine 0 N--CA 1.443 -0.885 0 CA-C-N 114.134 -1.394 . . . . 0.53000000000000003 111.139 178.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -115.2 160.5 19.65 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.079 0.466 . . . . 0.76000000000000001 111.23 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.7 t -101.17 147.65 26.0 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.391 -0.822 . . . . 0.52000000000000002 109.628 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.49 ' CE2' HG13 ' A' ' 10' ' ' VAL . 0.5 OUTLIER -79.31 -44.53 21.45 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.355 -0.609 . . . . 3.3599999999999999 109.355 173.773 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.454 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 6.3 p -64.65 -32.94 74.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.384 -0.826 . . . . 1.3700000000000001 111.76 -172.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -59.62 -24.29 63.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.136 0.493 . . . . 1.1100000000000001 111.698 178.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.571 ' O ' ' HB2' ' A' ' 124' ' ' SER . 22.2 m-85 -120.46 13.57 11.82 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.898 -0.592 . . . . 1.28 110.897 -175.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.579 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 60.3 p -101.11 -178.53 3.77 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.923 0.712 . . . . 1.8100000000000001 112.923 -170.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.599 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 4.2 t70 -170.54 -26.93 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.324 -1.307 . . . . 2.3100000000000001 109.359 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.842 HG23 ' H ' ' A' ' 31' ' ' GLU . 10.7 m -45.16 -70.68 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-N 114.424 -1.262 . . . . 0.92000000000000004 113.075 -173.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.842 ' H ' HG23 ' A' ' 30' ' ' VAL . 7.9 pt-20 -100.79 2.28 41.06 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.179 -0.675 . . . . 2.7400000000000002 109.179 176.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.599 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.7 tt0 -68.34 -60.36 2.51 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 114.798 -1.092 . . . . 1.45 111.38 -175.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 48.1 m-80 -92.55 -36.99 12.73 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.149 -0.478 . . . . 1.8700000000000001 111.1 -172.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 16.9 ptt180 -103.64 132.57 49.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.186 0.517 . . . . 3.3900000000000001 110.401 175.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 29.9 p -113.34 113.59 25.46 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.668 -0.696 . . . . 2.25 110.988 -177.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -131.93 -64.51 0.78 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.484 -0.78 . . . . 3.3399999999999999 110.65 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.418 ' HB2' ' HB3' ' A' ' 3' ' ' GLN . . . -62.49 144.94 95.28 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.347 -0.842 . . . . 1.9199999999999999 110.977 178.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.581 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 25.8 Cg_exo -63.87 177.26 1.93 Allowed 'Trans proline' 0 CA--C 1.529 0.242 0 C-N-CA 122.862 2.375 . . . . 1.8700000000000001 112.007 176.106 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -81.48 13.46 3.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.481 0.657 . . . . 4.6399999999999997 110.389 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 131.2 65.84 0.09 OUTLIER Glycine 0 N--CA 1.441 -1.013 0 CA-C-N 115.284 -0.871 . . . . 2.1499999999999999 111.229 -178.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.876 HG23 ' H ' ' A' ' 42' ' ' GLU . 1.6 t -66.77 -75.12 0.1 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 120.831 0.348 . . . . 1.1200000000000001 110.313 -176.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.876 ' H ' HG23 ' A' ' 41' ' ' THR . 3.6 pt-20 -94.15 -28.87 15.44 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 122.281 1.039 . . . . 2.02 108.48 167.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.45 ' HA ' ' HB ' ' A' ' 46' ' ' VAL . 0.0 OUTLIER -56.34 -38.52 71.47 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 112.829 -1.987 . . . . 1.25 113.686 -169.826 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.508 ' HA ' ' CD ' ' A' ' 47' ' ' LYS . 13.8 tp10 -47.9 -56.1 8.33 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 117.903 0.319 . . . . 1.9099999999999999 110.757 -174.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.512 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -66.14 -40.19 90.43 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.833 0.349 . . . . 0.52000000000000002 110.743 178.096 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.761 ' HA ' HG12 ' A' ' 152' ' ' VAL . 84.8 t -56.75 -59.94 2.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 121.572 0.701 . . . . 1.4099999999999999 111.134 178.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.658 ' CE ' ' HB3' ' A' ' 7' ' ' GLU . 4.2 ptmt -64.53 -30.77 71.8 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.811 -1.086 . . . . 0.67000000000000004 109.837 -176.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.773 ' HB3' ' HB3' ' A' ' 157' ' ' ASN . 8.2 mm100 -72.91 -27.35 61.81 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.566 -0.743 . . . . 0.98999999999999999 110.882 177.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.659 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -79.7 -34.61 40.03 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.127 0.489 . . . . 0.41999999999999998 109.814 175.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 mp -62.73 -35.8 80.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.339 -0.846 . . . . 1.3300000000000001 112.218 -178.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.572 ' HD3' ' NE2' ' A' ' 48' ' ' GLN . 11.6 ptm180 -68.99 -36.23 77.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.713 0.768 . . . . 2.1699999999999999 109.585 178.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.559 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 6.6 mt-10 -80.74 -37.29 30.75 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 114.874 -1.057 . . . . 1.1000000000000001 110.811 -174.198 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.42 -34.77 72.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.742 -0.663 . . . . 0.53000000000000003 109.667 171.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.58 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.92 -50.69 61.55 Favored Glycine 0 C--O 1.223 -0.593 0 CA-C-N 115.342 -0.844 . . . . 0.69999999999999996 112.431 179.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.607 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 28.1 t70 -54.29 -36.36 63.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.24 0.543 . . . . 1.04 111.099 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.533 ' O ' HD11 ' A' ' 59' ' ' LEU . 4.3 tt0 -76.98 -27.6 54.79 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.422 -0.808 . . . . 2.29 110.867 -178.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.485 ' CE1' ' HA2' ' B' 1012 ' ' GLY . 0.1 OUTLIER -82.87 -54.12 5.34 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.773 -0.649 . . . . 2.29 111.791 178.965 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.61 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 17.2 mt-10 -55.39 -54.5 42.91 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.975 0.731 . . . . 1.3 112.975 -168.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.731 HD12 ' H ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER -42.48 -41.31 2.9 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.739 1.014 . . . . 1.54 113.739 -172.862 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.731 ' H ' HD12 ' A' ' 59' ' ' LEU . 36.4 mtm180 -59.41 -59.45 5.42 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 111.939 0.348 . . . . 2.5800000000000001 111.939 -176.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.61 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 0.3 OUTLIER -91.77 -5.67 53.14 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.052 0.76 . . . . 5.3200000000000003 113.052 -175.352 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 24.6 ptt180 -66.42 -15.09 63.05 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 122.246 -0.284 . . . . 4.4800000000000004 111.539 -175.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.427 HH11 ' HD2' ' A' ' 63' ' ' ARG . 37.7 mtm105 -67.87 -15.95 63.86 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.243 -0.435 . . . . 4.7199999999999998 111.438 179.336 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.744 ' O ' ' HG ' ' A' ' 68' ' ' LEU . . . -92.38 -35.06 13.91 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.585 0.217 . . . . 1.1699999999999999 111.585 175.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.653 ' HE1' HD11 ' B' 1008 ' ' LEU . 9.6 m-30 -43.32 -50.53 6.63 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.141 1.163 . . . . 2.8100000000000001 114.141 -168.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 18.6 m -72.79 -20.53 61.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.101 0.477 . . . . 2.1899999999999999 111.41 -171.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -90.41 -23.98 20.89 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.785 -0.643 . . . . 2.7200000000000002 110.297 178.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.744 ' HG ' ' O ' ' A' ' 64' ' ' ALA . 70.1 mt -77.65 -16.06 58.78 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 113.012 0.745 . . . . 1.5600000000000001 113.012 -173.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.572 HG22 HG13 ' A' ' 74' ' ' ILE . 3.5 p -56.15 -28.9 59.78 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.27 0.47 . . . . 0.69999999999999996 112.27 -172.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.2 t -67.37 -36.62 81.75 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.39 0.614 . . . . 1.3400000000000001 109.823 175.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.603 ' NE2' HD22 ' A' ' 68' ' ' LEU . 17.1 mt-30 -72.43 -41.59 66.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.321 -0.854 . . . . 1.4199999999999999 109.765 177.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.433 ' HB2' HG12 ' A' ' 74' ' ' ILE . 3.5 mm? -65.71 -32.2 73.61 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.05 -0.523 . . . . 1.3700000000000001 110.921 176.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.423 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 38.6 m80 63.9 40.44 7.41 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.887 -0.783 . . . . 2.7200000000000002 108.887 -173.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.576 HG21 ' HB3' ' A' ' 113' ' ' GLU . 35.9 mm -49.62 113.74 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-N 114.447 -1.251 . . . . 0.91000000000000003 111.441 -178.198 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.775 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.7 OUTLIER -160.81 -170.37 0.24 Allowed Pre-proline 0 CA--C 1.548 0.887 0 N-CA-C 107.922 -1.14 . . . . 0.51000000000000001 107.922 -168.633 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.775 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 50.3 Cg_exo -28.71 166.88 0.0 OUTLIER 'Trans proline' 0 C--N 1.359 1.089 1 C-N-CA 125.407 4.072 . . . . 0.46999999999999997 115.537 162.857 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -29.87 -29.18 0.01 OUTLIER Glycine 0 N--CA 1.472 1.053 0 N-CA-C 117.261 1.664 . . . . 0.40000000000000002 117.261 -173.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 81' ' ' GLN . 32.9 p -68.51 3.36 1.84 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 117.93 0.865 . . . . 0.56000000000000005 111.997 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -72.64 -13.39 61.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.339 0.59 . . . . 0.34000000000000002 109.564 170.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.435 ' O ' ' HB2' ' A' ' 84' ' ' GLU . 50.2 t80 -75.45 -18.43 59.88 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 115.703 -0.68 . . . . 4.1299999999999999 109.234 173.289 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.525 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 74.2 mt-30 -80.42 -26.99 38.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 122.199 1.0 . . . . 1.03 109.416 172.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 1.3 m -78.09 -33.05 50.93 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 114.188 -1.369 . . . . 0.47999999999999998 110.039 175.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.675 ' HB2' ' HG ' ' A' ' 110' ' ' LEU . 67.7 t80 -80.42 -17.07 52.89 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.583 0.706 . . . . 1.1799999999999999 109.378 172.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.582 ' HA ' HG12 ' A' ' 87' ' ' VAL . 35.3 tt0 -68.2 -57.99 5.14 Favored 'General case' 0 CA--C 1.498 -1.054 0 CA-C-N 115.109 -0.95 . . . . 0.80000000000000004 111.178 -174.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.573 ' HG3' ' N ' ' A' ' 86' ' ' VAL . 3.2 pt20 -43.95 -38.88 3.69 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-N 113.557 -1.656 . . . . 1.6200000000000001 110.932 178.236 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.587 HG21 ' CE2' ' A' ' 106' ' ' PHE . 1.5 t -78.28 -53.94 13.11 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.734 0 CA-C-N 112.465 -2.152 . . . . 1.3 111.142 -177.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.582 HG12 ' HA ' ' A' ' 84' ' ' GLU . 8.6 p -60.73 -21.61 24.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 122.057 0.932 . . . . 0.84999999999999998 109.445 -178.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.455 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 2.7 m-80 -70.96 -43.77 67.42 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 113.897 -1.501 . . . . 0.91000000000000003 111.34 173.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.629 ' OE1' ' HA ' ' B' 1009 ' ' ALA . 2.0 pp20? -73.01 -37.56 66.92 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 121.767 0.794 . . . . 2.8700000000000001 109.055 177.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.911 HD12 HH11 ' A' ' 99' ' ' ARG . 3.5 tp -66.74 -19.82 65.83 Favored 'General case' 0 N--CA 1.433 -1.31 0 CA-C-N 113.731 -1.577 . . . . 1.28 112.015 -165.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.652 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 2.6 p90 -110.64 -28.82 8.29 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 120.524 -0.471 . . . . 2.2999999999999998 112.0 -173.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.549 ' HD3' ' HA ' ' A' ' 89' ' ' GLU . 9.9 ptm180 -72.94 -39.31 66.33 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.289 0.566 . . . . 5.0599999999999996 111.534 -171.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -88.93 13.44 12.76 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.269 -0.878 . . . . 3.1200000000000001 113.361 -169.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.593 ' O ' ' HG3' ' A' ' 99' ' ' ARG . . . 128.46 70.66 0.14 Allowed Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 116.952 -2.547 . . . . 2.3100000000000001 115.459 178.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.652 ' CG2' ' HA ' ' A' ' 91' ' ' PHE . 75.0 t -72.06 104.48 1.75 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 118.417 1.109 . . . . 1.0600000000000001 111.066 178.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -111.24 -170.22 1.6 Allowed 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.224 -1.353 . . . . 2.1200000000000001 108.712 177.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 10.8 m-90 -56.1 -46.35 79.11 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 123.515 0.509 . . . . 3.3399999999999999 111.192 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.758 ' HA3' HG21 ' B' 1015 ' ' ILE . . . -79.05 -30.62 46.13 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.957 -0.64 . . . . 0.68999999999999995 113.938 -175.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.911 HH11 HD12 ' A' ' 90' ' ' LEU . 16.6 mmt180 -55.61 -42.44 74.89 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 117.216 0.508 . . . . 4.2400000000000002 111.553 -178.03 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.574 HG22 ' CE2' ' A' ' 104' ' ' PHE . 55.0 mt -67.8 -38.57 80.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.969 -0.56 . . . . 0.44 110.678 -178.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 52.0 t -53.97 -54.18 22.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.937 -0.574 . . . . 1.3500000000000001 110.033 172.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.4 ' O ' ' HB3' ' A' ' 105' ' ' SER . . . -55.68 -40.62 72.56 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.503 -0.772 . . . . 0.44 111.227 177.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.4 ' CD1' HG23 ' A' ' 87' ' ' VAL . 6.7 t80 -58.9 -40.96 86.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.372 -0.831 . . . . 1.49 111.069 177.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.574 ' CE2' HG22 ' A' ' 100' ' ' ILE . 39.1 m-85 -71.11 -34.09 70.77 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.694 0.283 . . . . 3.29 110.506 175.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.607 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 25.3 t -58.95 -57.49 12.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.078 -0.51 . . . . 1.1899999999999999 111.127 178.165 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.587 ' CE2' HG21 ' A' ' 86' ' ' VAL . 34.6 t80 -68.11 -31.89 71.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.852 0.358 . . . . 2.8900000000000001 110.231 -178.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.483 ' HA3' ' CE ' ' A' ' 130' ' ' MET . . . -67.3 -46.21 73.09 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.786 -0.721 . . . . 0.29999999999999999 111.785 177.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.908 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -65.56 -31.98 81.84 Favored Glycine 0 N--CA 1.441 -0.982 0 C-N-CA 120.646 -0.787 . . . . 0.23000000000000001 111.148 176.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.45 -30.56 67.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.577 -0.311 . . . . 0.31 110.526 175.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.675 ' HG ' ' HB2' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -65.02 -42.54 94.3 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 107.974 -1.121 . . . . 1.1200000000000001 107.974 178.795 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.735 ' SG ' HG22 ' A' ' 123' ' ' VAL . 38.2 t -52.74 -54.8 28.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.101 -1.409 . . . . 0.26000000000000001 110.479 172.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.5 ' CG1' ' HE2' ' A' ' 20' ' ' LYS . 73.8 t -62.97 -42.78 97.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.202 -0.453 . . . . 0.34999999999999998 111.864 -177.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.576 ' HB3' HG21 ' A' ' 74' ' ' ILE . 3.4 mm-40 -59.08 -29.13 67.11 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.606 -0.438 . . . . 2.5099999999999998 110.991 178.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.401 ' HA ' ' CE ' ' A' ' 119' ' ' MET . 47.7 m -73.31 -39.23 65.45 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.963 -0.754 . . . . 0.28000000000000003 108.963 176.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.639 ' HA ' ' HG3' ' A' ' 120' ' ' GLN . 80.5 t -67.07 -38.13 80.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.213 -0.903 . . . . 1.23 109.397 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -52.75 -50.44 63.48 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 113.364 -1.744 . . . . 0.59999999999999998 111.338 -179.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 113' ' ' GLU . 20.7 mmtt -88.18 16.18 6.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.137 -0.483 . . . . 1.6200000000000001 110.394 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.568 ' HA ' HE21 ' A' ' 120' ' ' GLN . 45.5 mt-10 63.87 49.32 2.89 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.82 0.819 . . . . 1.8799999999999999 110.729 178.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.564 ' HE1' HG22 ' A' ' 74' ' ' ILE . 26.4 mtm -130.67 44.69 2.92 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.627 -1.17 . . . . 0.31 108.203 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.639 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 3.4 mp0 -62.45 -6.99 3.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.283 -0.871 . . . . 1.1499999999999999 112.958 -173.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.537 HG23 HD22 ' A' ' 122' ' ' LEU . 26.6 m -66.01 -21.85 29.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 O-C-N 122.14 -0.35 . . . . 0.46000000000000002 111.577 176.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.688 HD13 ' HD3' ' A' ' 125' ' ' ARG . 3.3 mm? -75.53 -25.24 57.02 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 110.291 -0.263 . . . . 0.26000000000000001 110.291 178.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.735 HG22 ' SG ' ' A' ' 111' ' ' CYS . 49.6 t -43.86 -53.63 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 O-C-N 123.917 0.761 . . . . 0.25 112.059 179.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.579 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 12.6 t -71.99 -37.77 69.8 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.853 -0.339 . . . . 1.3500000000000001 110.718 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.688 ' HD3' HD13 ' A' ' 122' ' ' LEU . 63.7 mtp180 -61.0 -56.52 20.11 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-N 116.305 -0.407 . . . . 2.6699999999999999 110.512 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.59 HG22 ' SD ' ' A' ' 130' ' ' MET . 70.7 mt -52.25 -50.67 36.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.807 -0.633 . . . . 0.23000000000000001 110.305 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.8 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -57.18 -36.17 70.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.851 0.358 . . . . 0.28999999999999998 111.378 179.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.969 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -63.54 -57.69 9.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.311 0.577 . . . . 0.28000000000000003 110.556 176.137 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -66.72 -26.9 67.23 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 114.719 -1.128 . . . . 3.9100000000000001 111.197 -174.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.59 ' SD ' HG22 ' A' ' 126' ' ' ILE . 89.7 mtp -69.23 -53.99 17.05 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.081 0.467 . . . . 1.0800000000000001 110.972 175.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.511 ' CA ' HG21 ' A' ' 9' ' ' VAL . . . -59.33 -39.26 82.59 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.8 -0.636 . . . . 0.25 111.073 -178.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 86.7 m -63.56 -47.32 82.04 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.763 -0.375 . . . . 0.40000000000000002 111.022 176.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.589 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 12.1 t80 -55.43 -39.35 70.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.178 0.514 . . . . 3.1299999999999999 109.847 178.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.883 ' HA ' ' HB2' ' A' ' 138' ' ' LEU . 0.3 OUTLIER -59.91 -60.71 3.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.821 -0.627 . . . . 0.94999999999999996 109.855 170.833 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -45.94 -44.36 14.72 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.054 -0.975 . . . . 0.46000000000000002 113.245 -179.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -86.14 -51.87 6.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.989 0.423 . . . . 0.58999999999999997 112.047 -178.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . 0.589 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 8.7 m80 -89.54 -49.7 6.52 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.889 0.7 . . . . 1.45 112.889 -168.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.883 ' HB2' ' HA ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -76.71 -44.82 31.94 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 113.0 0.741 . . . . 1.2 113.0 -169.906 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.618 ' HA ' HD12 ' A' ' 142' ' ' ILE . 17.6 tt0 -42.23 -53.57 8.6 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.106 -0.952 . . . . 0.75 113.254 -171.576 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.545 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 24.3 Cg_exo -63.11 -42.55 22.76 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 121.76 1.64 . . . . 0.56000000000000005 111.634 178.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . 0.507 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 0.1 OUTLIER -56.8 -48.71 77.33 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.283 -0.871 . . . . 1.2 110.421 177.514 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.618 HD12 ' HA ' ' A' ' 139' ' ' GLU . 42.6 mt -49.76 -49.71 19.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.266 -0.879 . . . . 0.32000000000000001 111.455 175.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 75.5 mm-40 -58.86 -32.64 69.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.543 -0.753 . . . . 0.56999999999999995 111.355 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.1 mm-40 -66.42 -19.45 65.8 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.304 0.574 . . . . 0.78000000000000003 111.1 176.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.623 ' N ' HD22 ' A' ' 145' ' ' ASN . 0.7 OUTLIER -108.0 3.25 23.86 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.469 -0.787 . . . . 0.93000000000000005 109.522 -175.759 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.32 -49.17 0.89 Allowed Glycine 0 N--CA 1.44 -1.081 0 CA-C-N 115.156 -0.929 . . . . 0.56000000000000005 112.764 175.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.447 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 139.66 178.95 17.19 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.765 -0.731 . . . . 0.48999999999999999 111.757 -177.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.611 ' HZ2' ' HG3' ' A' ' 139' ' ' GLU . 19.0 m-90 -68.41 -42.53 78.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.694 0.283 . . . . 3.5699999999999998 110.614 -178.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 3.5 m-20 -57.75 -33.91 68.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.172 -0.467 . . . . 1.96 110.369 176.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.539 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 50.2 m -59.71 -40.77 89.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.116 -0.493 . . . . 0.67000000000000004 111.488 178.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.56 ' CD2' ' HA ' ' A' ' 148' ' ' TRP . 19.5 m-85 -59.75 -36.16 76.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.248 0.547 . . . . 3.0 109.756 -178.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.761 HG12 ' HA ' ' A' ' 46' ' ' VAL . 1.4 m -81.28 -24.54 10.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.652 -0.703 . . . . 1.1499999999999999 110.17 178.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 11.2 mm-40 -59.19 -26.68 65.01 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.123 0.487 . . . . 1.6699999999999999 109.964 171.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 150' ' ' THR . 1.4 mt -97.53 -55.22 2.89 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.718 -0.673 . . . . 1.3 110.737 179.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 56.3 m-85 -112.47 16.98 19.65 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.059 -0.518 . . . . 4.2400000000000002 111.749 -170.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.659 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -63.8 159.77 38.74 Favored Glycine 0 CA--C 1.497 -1.071 0 CA-C-O 122.605 1.114 . . . . 1.1000000000000001 115.164 -168.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.773 ' HB3' ' HB3' ' A' ' 48' ' ' GLN . 46.5 t-20 -114.03 146.03 40.75 Favored 'General case' 0 N--CA 1.426 -1.652 0 CA-C-N 112.599 -1.8 . . . . 1.29 109.68 -174.343 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.571 ' O ' ' HG2' ' A' ' 162' ' ' GLU . 1.6 p-10 -95.5 16.34 17.31 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.986 -0.286 . . . . 2.9900000000000002 111.239 -176.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -50.15 -42.49 50.95 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.15 -0.477 . . . . 2.52 111.938 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -77.09 -35.66 56.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.689 0.28 . . . . 2.8700000000000001 110.432 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -54.95 -58.24 8.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.896 -0.593 . . . . 3.2000000000000002 111.326 177.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 158' ' ' ASN . 4.2 pt-20 -64.73 -33.52 76.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.956 -0.566 . . . . 3.7200000000000002 111.411 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 33.3 t -63.5 -45.73 89.33 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.034 0.445 . . . . 4.1799999999999997 109.955 178.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . . . . . . . . . 23.6 mmm180 -75.07 -16.92 60.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.212 0.53 . . . . 5.8200000000000003 110.801 179.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -77.86 -19.79 54.21 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.309 -0.859 . . . . 4.7699999999999996 110.589 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -52.58 -49.48 52.52 Favored Glycine 0 C--N 1.331 0.268 0 CA-C-N 115.961 -0.563 . . . . 5.0999999999999996 113.624 -174.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -75.21 -23.98 57.69 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.088 0.47 . . . . 5.7199999999999998 111.293 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -84.3 3.25 36.44 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.163 0.506 . . . . 5.8799999999999999 110.199 -179.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.65 ' HD3' ' O ' ' A' ' 169' ' ' ARG . 3.0 tmt_? -82.57 -17.84 43.44 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.527 -0.916 . . . . 7.3399999999999999 108.527 175.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -86.18 7.44 25.01 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.312 -0.858 . . . . 6.9699999999999998 110.48 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 40.2 mm-40 66.82 -176.97 0.2 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.59 -0.732 . . . . 6.9699999999999998 111.548 177.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 -137.04 137.51 39.44 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.103 -0.499 . . . . 9.3499999999999996 110.132 177.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -114.36 131.35 56.58 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.75 -0.463 . . . . 11.4 109.75 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . 0.503 ' CE1' ' HB2' ' A' ' 177' ' ' HIS . 60.3 t60 -86.94 94.84 9.71 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.964 0.411 . . . . 11.52 110.103 -179.13 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 71.5 t60 -109.94 -39.32 5.1 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.035 -0.529 . . . . 14.48 109.933 177.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 10.2 t60 -143.76 114.03 7.41 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.092 -0.503 . . . . 15.369999999999999 110.109 -178.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . 0.503 ' HB2' ' CE1' ' A' ' 174' ' ' HIS . 55.8 t-80 -90.39 129.98 36.52 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.751 -0.462 . . . . 16.02 109.751 177.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.454 HD23 ' H ' ' A' ' 178' ' ' LEU . 1.8 pt? -132.48 135.12 45.82 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 109.743 -0.466 . . . . 17.989999999999998 109.743 178.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -120.11 -45.01 2.47 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.033 0.444 . . . . 19.190000000000001 110.148 -178.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 15.8 m-70 -82.25 122.28 27.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.989 -0.55 . . . . 22.260000000000002 110.147 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 60.2 m80 -69.31 -26.51 64.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.942 0.401 . . . . 22.510000000000002 110.439 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 29.6 m-70 -74.28 105.54 5.51 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.523 -0.547 . . . . 24.890000000000001 109.523 172.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 29.2 m80 -91.02 87.77 6.73 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.187 -0.461 . . . . 25.579999999999998 110.134 -174.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 74.15 -9.59 1.25 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.673 -0.694 . . . . 27.370000000000001 111.509 177.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 11.2 p80 . . . . . 0 C--O 1.245 0.854 0 CA-C-O 118.252 -0.88 . . . . 29.059999999999999 110.076 176.254 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . 0.507 ' O ' ' HD3' ' B' 1006 ' ' ARG . . . . . . . . 0 C--O 1.234 0.257 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -81.33 -28.88 42.54 Favored Glycine 0 N--CA 1.451 -0.349 0 O-C-N 121.555 -0.715 . . . . 2.9700000000000002 112.018 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.654 ' HA ' ' C2 ' ' B' 1100 ' ' 33B . 14.1 m -110.78 -160.79 0.73 Allowed 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 110.189 -0.3 . . . . 1.9399999999999999 110.189 178.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.568 ' HA ' HD22 ' B' 1008 ' ' LEU . 0.8 OUTLIER 39.81 -87.65 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 O-C-N 124.708 1.255 . . . . 1.6299999999999999 113.536 175.41 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . . . . . . . . . . . -29.82 -44.05 0.06 OUTLIER Glycine 0 CA--C 1.532 1.124 0 CA-C-N 117.844 0.293 . . . . 1.2 113.829 161.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . 0.507 ' HD3' ' O ' ' B' 1001 ' ' ACE . 3.4 mpt_? -98.43 -13.59 20.51 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 113.027 0.751 . . . . 2.8799999999999999 113.027 177.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . . . . . . . . . . . -97.13 -53.09 3.6 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.306 0.484 . . . . 1.3100000000000001 112.306 -170.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.653 HD11 ' HE1' ' A' ' 65' ' ' PHE . 2.7 mm? -64.38 -46.93 81.24 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 108.832 -0.803 . . . . 1.3300000000000001 108.832 178.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 0.629 ' HA ' ' OE1' ' A' ' 89' ' ' GLU . . . -38.96 -51.8 1.79 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.326 -1.306 . . . . 0.88 111.739 167.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.834 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -77.67 -55.6 5.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.536 -1.211 . . . . 1.03 111.975 -173.285 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.661 ' CE2' ' H8 ' ' B' 1100 ' ' 33B . 53.0 m-85 -66.02 -21.74 66.41 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.157 -0.474 . . . . 1.6699999999999999 110.692 -178.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . 0.485 ' HA2' ' CE1' ' A' ' 57' ' ' PHE . . . -80.27 -5.61 89.64 Favored Glycine 0 N--CA 1.447 -0.616 0 CA-C-N 115.836 -0.62 . . . . 0.78000000000000003 112.796 -179.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 34.8 t70 -82.65 -8.78 59.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.323 0.583 . . . . 1.8999999999999999 109.892 174.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 3.2 m -100.01 87.36 3.47 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.488 -0.93 . . . . 1.4399999999999999 108.488 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.758 HG21 ' HA3' ' A' ' 98' ' ' GLY . 18.0 mt -102.87 -78.45 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-N 116.283 -0.417 . . . . 2.9100000000000001 111.077 -171.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 44.4 t30 -131.11 91.0 2.97 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.079 -0.51 . . . . 4.29 110.628 -175.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 66.0 mtm180 -122.21 -74.06 0.63 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.997 -0.547 . . . . 8.1699999999999999 110.313 178.087 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.648 -0.251 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.834 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.516 ' HE3' ' HB3' ' A' ' 135' ' ' ASN . 86.1 mtp . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 120.832 0.349 . . . . 6.21 110.092 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.4 m -95.47 157.27 15.97 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.647 -0.501 . . . . 1.8700000000000001 109.647 178.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.422 ' O ' ' HB2' ' A' ' 37' ' ' ALA . 27.8 mp0 -100.08 -7.85 24.45 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.884 0.373 . . . . 2.4199999999999999 110.153 179.31 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.445 ' O ' HD13 ' A' ' 8' ' ' LEU . 1.7 p -60.27 -23.29 64.01 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.838 -0.619 . . . . 1.25 112.03 -179.071 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.576 ' HA ' HD22 ' A' ' 8' ' ' LEU . 3.9 p30 -67.58 -22.32 65.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.931 -0.577 . . . . 1.78 111.115 176.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.843 HH12 ' HA ' ' A' ' 128' ' ' ALA . 23.9 tpp180 -58.23 -50.69 72.67 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.235 0.541 . . . . 1.3999999999999999 109.864 175.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.716 ' OE1' ' HA2' ' A' ' 40' ' ' GLY . 33.6 mt-10 -50.62 -55.71 15.13 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.324 -1.307 . . . . 0.68000000000000005 110.808 -179.084 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.576 HD22 ' HA ' ' A' ' 5' ' ' ASN . 2.8 mp -43.61 -45.97 7.01 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.151 -0.931 . . . . 1.1599999999999999 111.345 176.694 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 69.5 t -70.2 -60.74 2.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.121 0.486 . . . . 0.27000000000000002 110.662 178.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 6' ' ' ARG . 63.7 t -53.57 -53.46 25.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.482 -0.781 . . . . 0.33000000000000002 112.477 -175.275 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -54.25 -35.37 62.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.483 -0.78 . . . . 0.58999999999999997 111.126 -175.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.57 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 15.2 t80 -88.34 -37.33 16.03 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 120.478 -0.489 . . . . 1.6100000000000001 112.14 -175.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 1.013 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 2.8 mp -60.43 -36.93 79.34 Favored 'General case' 0 CA--C 1.521 -0.152 0 C-N-CA 119.386 -0.926 . . . . 0.34000000000000002 109.301 176.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.528 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 35.7 t -63.35 -37.37 87.0 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.642 -0.708 . . . . 1.05 110.354 175.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -71.41 -26.09 62.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.666 -0.697 . . . . 1.22 110.48 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.57 ' HG2' ' O ' ' A' ' 12' ' ' PHE . 12.8 mmmt -75.86 -43.15 47.06 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 112.133 0.42 . . . . 1.4099999999999999 112.133 -179.227 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.58 HD22 ' O ' ' A' ' 13' ' ' LEU . 0.2 OUTLIER -59.53 -19.08 45.74 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.672 0.272 . . . . 1.3500000000000001 111.327 177.139 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 6.1 t -60.37 -44.32 95.71 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 112.322 0.489 . . . . 0.93999999999999995 112.322 -176.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -66.97 -10.54 50.51 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.631 0.729 . . . . 1.3700000000000001 111.673 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.417 ' HD3' HG11 ' A' ' 112' ' ' VAL . 19.8 mmmt -105.85 -30.2 9.53 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 122.079 0.942 . . . . 2.2000000000000002 108.936 -177.286 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.17 19.34 21.6 Favored Glycine 0 N--CA 1.442 -0.948 0 CA-C-N 114.297 -1.32 . . . . 0.53000000000000003 111.622 175.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -102.38 162.88 12.57 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.771 0.319 . . . . 0.76000000000000001 110.852 -179.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.2 t -98.11 149.86 22.06 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 115.961 -0.563 . . . . 0.52000000000000002 110.397 178.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.596 ' HH2' ' HB2' ' A' ' 127' ' ' ALA . 52.4 t-105 -77.84 -52.72 8.44 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 115.225 -0.898 . . . . 3.3599999999999999 109.968 174.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.7 m -68.49 -22.16 64.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.823 -0.626 . . . . 1.3700000000000001 112.248 -172.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -67.2 -27.69 67.47 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.745 -0.382 . . . . 1.1100000000000001 111.73 178.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -115.58 -8.48 12.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.215 -0.448 . . . . 1.28 111.894 -174.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.639 ' HB3' HG22 ' A' ' 30' ' ' VAL . 49.5 m -101.66 154.34 18.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.715 0.769 . . . . 1.8100000000000001 113.066 -174.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.534 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 3.8 t70 -115.58 -14.8 11.48 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 113.879 -1.509 . . . . 2.3100000000000001 109.828 -179.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.856 HG23 ' H ' ' A' ' 31' ' ' GLU . 3.0 m -48.48 -73.01 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.463 -1.244 . . . . 0.92000000000000004 113.092 -167.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.856 ' H ' HG23 ' A' ' 30' ' ' VAL . 44.2 mt-10 -92.14 0.89 57.47 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.561 -0.533 . . . . 2.7400000000000002 109.561 176.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.534 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 27.9 tt0 -64.18 -51.14 65.24 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.547 -0.751 . . . . 1.45 110.482 -178.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -101.07 -75.89 0.58 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.95 -0.568 . . . . 1.8700000000000001 111.043 -176.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -79.82 161.43 25.66 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.506 -0.316 . . . . 3.3900000000000001 110.19 -179.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.1 p -129.96 98.33 4.74 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.511 0.672 . . . . 2.25 110.978 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.967 ' HG3' ' H ' ' A' ' 37' ' ' ALA . 6.2 pt-20 -95.64 -83.37 0.37 Allowed 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.095 -0.957 . . . . 3.3399999999999999 111.103 -179.209 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.967 ' H ' ' HG3' ' A' ' 36' ' ' GLU . . . -62.82 137.85 96.88 Favored Pre-proline 0 C--N 1.312 -1.036 0 CA-C-N 114.697 -1.138 . . . . 1.9199999999999999 111.941 178.103 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.776 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 38.5 Cg_exo -62.12 174.26 2.66 Favored 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 123.172 2.582 . . . . 1.8700000000000001 111.691 173.279 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -74.19 -7.5 52.88 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.122 0.487 . . . . 4.6399999999999997 110.609 179.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.716 ' HA2' ' OE1' ' A' ' 7' ' ' GLU . . . 160.07 69.16 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.651 -0.704 . . . . 2.1499999999999999 111.55 179.166 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.833 HG23 ' H ' ' A' ' 42' ' ' GLU . 2.2 t -72.75 -75.55 0.14 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 120.456 -0.498 . . . . 1.1200000000000001 111.022 -173.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.833 ' H ' HG23 ' A' ' 41' ' ' THR . 13.9 pt-20 -92.91 -30.99 15.11 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-O 122.374 1.083 . . . . 2.02 109.454 174.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.805 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 66.3 m -69.84 -16.63 63.29 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 113.218 -1.81 . . . . 1.25 114.323 -167.159 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -42.81 -41.85 3.39 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 118.254 0.479 . . . . 1.9099999999999999 111.831 -178.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.44 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -83.65 -42.29 16.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.075 0.464 . . . . 0.52000000000000002 110.47 174.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.701 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 75.9 t -46.95 -66.91 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.362 0 C-N-CA 124.05 0.94 . . . . 1.4099999999999999 111.857 175.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.805 ' HG2' ' O ' ' A' ' 43' ' ' SER . 18.7 ptpt -61.27 -38.1 85.52 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.742 -0.663 . . . . 0.67000000000000004 110.462 -177.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.753 HE21 ' HA ' ' A' ' 48' ' ' GLN . 0.0 OUTLIER -59.61 -27.23 66.12 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-N 116.233 -0.44 . . . . 0.98999999999999999 110.958 175.365 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.812 ' HB2' ' HA2' ' A' ' 156' ' ' GLY . . . -83.84 -45.75 12.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.235 0.541 . . . . 0.41999999999999998 110.413 172.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.686 ' HB2' ' HA ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -49.05 -42.25 37.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.826 -1.079 . . . . 1.3300000000000001 112.003 -179.697 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.649 ' HD2' ' NE2' ' A' ' 48' ' ' GLN . 8.4 ptp180 -76.88 -28.45 55.4 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.336 0.589 . . . . 2.1699999999999999 110.017 -170.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.438 ' HG2' ' HG3' ' A' ' 51' ' ' ARG . 19.1 mm-40 -77.85 -44.18 28.05 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.911 -1.041 . . . . 1.1000000000000001 110.182 178.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.21 -43.46 98.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.665 -0.698 . . . . 0.53000000000000003 109.695 174.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.699 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -62.87 -41.46 99.87 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-N 115.556 -0.747 . . . . 0.69999999999999996 111.48 175.054 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -52.56 -39.3 61.32 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 122.786 0.434 . . . . 1.04 111.123 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.419 ' HA ' HD11 ' A' ' 59' ' ' LEU . 50.7 mt-10 -80.05 -27.19 39.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.12 -0.491 . . . . 2.29 111.498 178.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.908 ' HZ ' ' HA2' ' B' 1012 ' ' GLY . 1.4 t80 -80.84 -27.46 36.46 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 116.537 -0.301 . . . . 2.29 111.235 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.798 ' HA ' ' CE1' ' A' ' 61' ' ' TYR . 47.7 mt-10 -56.26 -65.48 0.6 Allowed 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 111.932 0.345 . . . . 1.3 111.932 -176.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.79 ' H ' HD13 ' A' ' 59' ' ' LEU . 0.0 OUTLIER -52.05 -35.44 47.31 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.323 0.39 . . . . 1.54 111.337 -178.616 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.704 ' N ' HD22 ' A' ' 59' ' ' LEU . 46.0 mtt180 -52.83 -55.18 24.91 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.58 -0.736 . . . . 2.5800000000000001 111.756 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.798 ' CE1' ' HA ' ' A' ' 58' ' ' GLU . 29.3 p90 -90.78 -19.68 23.21 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 120.682 -0.407 . . . . 5.3200000000000003 111.757 -177.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -58.81 -30.11 67.39 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 122.681 0.392 . . . . 4.4800000000000004 111.55 -174.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -62.64 -37.16 85.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.933 0.397 . . . . 4.7199999999999998 110.685 178.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.464 ' HB1' HD13 ' A' ' 68' ' ' LEU . . . -90.41 -31.23 16.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.264 -0.426 . . . . 1.1699999999999999 110.807 178.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.585 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 56.9 t80 -42.55 -48.47 5.34 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.821 0.848 . . . . 2.8100000000000001 113.199 -174.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 12.5 t -62.75 -38.14 89.37 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.861 0.362 . . . . 2.1899999999999999 110.945 -174.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -87.57 -28.14 22.14 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.0 0.429 . . . . 2.7200000000000002 110.762 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.656 ' HA ' ' NE2' ' A' ' 71' ' ' GLN . 0.5 OUTLIER -60.13 -22.5 62.91 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 113.099 0.777 . . . . 1.5600000000000001 113.099 -175.349 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.456 ' CG2' ' HG2' ' A' ' 113' ' ' GLU . 4.8 p -52.99 -26.99 17.09 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 117.999 0.363 . . . . 0.69999999999999996 111.391 -179.549 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.7 t -58.98 -58.25 9.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.377 0.608 . . . . 1.3400000000000001 110.055 173.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.891 ' NE2' ' H ' ' A' ' 71' ' ' GLN . 1.9 mp0 -51.35 -45.59 62.41 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 124.397 1.079 . . . . 1.4199999999999999 111.161 174.477 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.49 ' HB3' ' CD1' ' A' ' 74' ' ' ILE . 2.4 mm? -66.62 -31.86 72.82 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 116.056 -0.52 . . . . 1.3700000000000001 111.834 179.082 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 54.9 m80 57.1 42.64 25.49 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.65 -0.87 . . . . 2.7200000000000002 108.65 -174.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.508 HG22 ' HE1' ' A' ' 119' ' ' MET . 31.9 mm -49.67 115.66 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 113.582 -1.644 . . . . 0.91000000000000003 113.141 -173.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.772 ' OG1' ' HD2' ' A' ' 76' ' ' PRO . 0.6 OUTLIER -157.04 -171.61 0.29 Allowed Pre-proline 0 CA--C 1.551 0.988 0 CA-C-N 114.272 -1.331 . . . . 0.51000000000000001 107.798 -171.796 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.772 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 41.0 Cg_exo -28.63 166.67 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.335 1 C-N-CA 125.453 4.102 . . . . 0.46999999999999997 115.976 164.895 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.416 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -31.5 -27.17 0.01 OUTLIER Glycine 0 N--CA 1.474 1.203 0 N-CA-C 117.441 1.737 . . . . 0.40000000000000002 117.441 -173.078 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.432 ' N ' ' O ' ' A' ' 76' ' ' PRO . 24.1 p -69.39 4.34 1.81 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 117.888 0.844 . . . . 0.56000000000000005 112.007 -179.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.19 -14.58 63.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 121.393 0.616 . . . . 0.34000000000000002 109.742 172.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -76.6 -14.73 59.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.687 -0.688 . . . . 4.1299999999999999 109.92 176.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.496 ' O ' ' HB3' ' A' ' 84' ' ' GLU . 37.3 mt-30 -86.99 -24.11 24.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.623 0.725 . . . . 1.03 109.978 173.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.0 m -71.22 -51.19 26.08 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.711 -1.131 . . . . 0.47999999999999998 109.249 170.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -68.2 -15.94 63.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.82 -1.082 . . . . 1.1799999999999999 110.202 174.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.629 ' HA ' HG12 ' A' ' 87' ' ' VAL . 41.5 tt0 -64.22 -50.55 67.6 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.172 0.51 . . . . 0.80000000000000004 110.257 176.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.49 ' OE1' HG21 ' B' 1004 ' ' VAL . 53.4 mt-30 -44.43 -43.63 7.87 Favored 'General case' 0 CA--C 1.506 -0.748 0 CA-C-N 114.414 -1.266 . . . . 1.6200000000000001 111.302 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.676 ' O ' ' HG3' ' A' ' 89' ' ' GLU . 2.6 p -91.45 -36.77 8.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.612 0 CA-C-N 113.546 -1.661 . . . . 1.3 112.039 -171.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.629 HG12 ' HA ' ' A' ' 84' ' ' GLU . 6.9 p -66.38 -21.31 28.49 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 121.845 0.831 . . . . 0.84999999999999998 109.277 175.333 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.609 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 1.5 m-80 -72.74 -51.47 19.04 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.193 -1.367 . . . . 0.91000000000000003 111.137 175.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 1.024 ' HG2' ' HA2' ' B' 1005 ' ' GLY . 0.0 OUTLIER -64.96 -40.04 94.39 Favored 'General case' 0 CA--C 1.496 -1.109 0 N-CA-C 108.77 -0.826 . . . . 2.8700000000000001 108.77 -178.622 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.618 ' HG ' ' OE1' ' A' ' 89' ' ' GLU . 15.5 mt -57.21 -27.08 61.68 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-N 113.851 -1.522 . . . . 1.28 110.8 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.621 ' HA ' HG22 ' A' ' 95' ' ' VAL . 76.4 t80 -97.4 -49.05 5.06 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 121.341 0.591 . . . . 2.2999999999999998 110.727 -171.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.609 ' HD2' ' O ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER -75.56 -32.77 60.52 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.595 -0.73 . . . . 5.0599999999999996 110.885 -173.095 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.518 ' N ' ' HG2' ' A' ' 92' ' ' ARG . 1.4 m-20 -94.55 20.17 8.81 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.676 -0.693 . . . . 3.1200000000000001 112.549 -174.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 130.69 70.97 0.11 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 117.182 -2.437 . . . . 2.3100000000000001 116.116 177.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 1.042 ' HA ' ' HG2' ' A' ' 99' ' ' ARG . 46.6 t -75.88 98.86 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 118.927 1.363 . . . . 1.0600000000000001 111.271 171.714 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -113.35 -170.94 1.78 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 114.953 -1.021 . . . . 2.1200000000000001 109.601 177.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.685 ' HA ' ' CE2' ' A' ' 151' ' ' PHE . 13.6 m-90 -61.79 -46.7 88.42 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.112 -0.495 . . . . 3.3399999999999999 110.643 178.297 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.453 ' HA3' HG12 ' B' 1015 ' ' ILE . . . -78.54 -20.37 71.73 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.89 -0.595 . . . . 0.68999999999999995 113.9 -174.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 1.042 ' HG2' ' HA ' ' A' ' 95' ' ' VAL . 0.0 OUTLIER -68.91 -30.57 69.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 117.336 0.568 . . . . 4.2400000000000002 110.0 -176.335 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 85.4 mt -76.76 -32.36 20.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.329 -0.396 . . . . 0.44 110.642 -178.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.429 ' HA ' ' CD1' ' A' ' 104' ' ' PHE . 0.8 OUTLIER -63.84 -26.48 40.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-O 121.321 0.581 . . . . 1.3500000000000001 109.51 172.038 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -73.77 -49.24 26.37 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.396 -0.594 . . . . 0.44 109.396 173.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.665 ' HB2' ' NH1' ' A' ' 99' ' ' ARG . 32.7 t80 -49.93 -55.42 14.56 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 114.731 -1.122 . . . . 1.49 111.697 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.517 ' HA ' ' CE ' ' A' ' 130' ' ' MET . 0.2 OUTLIER -72.54 -18.46 61.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.974 0.416 . . . . 3.29 110.733 -174.278 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.561 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 23.0 t -81.75 -44.32 17.18 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.219 -0.446 . . . . 1.1899999999999999 110.524 177.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.566 ' CZ ' HD12 ' B' 1008 ' ' LEU . 19.9 m-30 -65.41 -39.92 92.74 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 116.441 -0.345 . . . . 2.8900000000000001 110.107 178.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . 0.839 ' HA3' ' SD ' ' A' ' 130' ' ' MET . . . -64.49 -37.25 94.19 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.821 -0.704 . . . . 0.29999999999999999 111.673 176.695 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 1.013 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -66.9 -34.56 87.5 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 120.539 -0.839 . . . . 0.23000000000000001 111.407 175.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.585 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -72.23 -34.1 68.06 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.8 0.333 . . . . 0.31 110.463 176.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.565 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -60.65 -40.14 90.93 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 122.21 1.005 . . . . 1.1200000000000001 108.514 179.564 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.692 ' HB2' HD23 ' A' ' 13' ' ' LEU . 33.3 t -52.74 -53.92 41.11 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 113.74 -1.573 . . . . 0.26000000000000001 110.344 173.322 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.417 HG11 ' HD3' ' A' ' 20' ' ' LYS . 54.4 t -61.21 -42.32 92.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.031 -0.531 . . . . 0.34999999999999998 111.54 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.487 ' HB3' HG21 ' A' ' 74' ' ' ILE . 32.1 mt-10 -55.41 -34.11 64.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.053 0.454 . . . . 2.5099999999999998 110.797 177.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.447 ' CB ' ' HB2' ' A' ' 122' ' ' LEU . 30.3 m -74.14 -38.09 63.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.466 0.65 . . . . 0.28000000000000003 109.268 178.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.644 ' HA ' ' HG3' ' A' ' 120' ' ' GLN . 85.9 t -67.51 -34.29 67.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 115.127 -0.942 . . . . 1.23 109.538 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -51.48 -50.31 60.1 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.594 -1.639 . . . . 0.59999999999999998 111.381 179.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 10.6 mmtp -89.74 11.9 18.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.03 -0.532 . . . . 1.6200000000000001 110.541 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 61.8 56.29 2.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.93 0.871 . . . . 1.8799999999999999 110.588 -176.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.508 ' HE1' HG22 ' A' ' 74' ' ' ILE . 32.7 mtm -129.44 43.68 3.1 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.388 -1.278 . . . . 0.31 107.61 178.034 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.644 ' HG3' ' HA ' ' A' ' 115' ' ' VAL . 14.1 mp0 -61.35 -7.14 2.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.877 -1.056 . . . . 1.1499999999999999 113.199 -172.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.597 HG23 HD22 ' A' ' 122' ' ' LEU . 17.9 m -62.94 -28.53 45.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 O-C-N 121.916 -0.49 . . . . 0.46000000000000002 111.187 173.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.755 HD13 ' HD2' ' A' ' 125' ' ' ARG . 3.4 mm? -69.36 -28.08 65.89 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 110.267 -0.271 . . . . 0.26000000000000001 110.267 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.691 HG22 ' SG ' ' A' ' 111' ' ' CYS . 54.7 t -43.04 -53.91 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 O-C-N 123.955 0.784 . . . . 0.25 112.124 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.604 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 3.3 t -75.1 -34.89 61.78 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.877 0.37 . . . . 1.3500000000000001 110.662 -178.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.755 ' HD2' HD13 ' A' ' 122' ' ' LEU . 93.0 mtt180 -64.22 -50.28 68.63 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-N 116.081 -0.509 . . . . 2.6699999999999999 110.803 -177.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.565 HD13 ' HB3' ' A' ' 110' ' ' LEU . 75.8 mt -55.12 -50.03 67.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.675 -0.693 . . . . 0.23000000000000001 110.614 179.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.596 ' HB2' ' HH2' ' A' ' 24' ' ' TRP . . . -56.7 -34.2 67.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.408 -0.36 . . . . 0.28999999999999998 111.639 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.843 ' HA ' HH12 ' A' ' 6' ' ' ARG . . . -59.41 -61.93 2.26 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 121.36 0.6 . . . . 0.28000000000000003 110.448 175.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -62.17 -31.87 72.42 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 114.853 -1.067 . . . . 3.9100000000000001 111.258 -177.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.839 ' SD ' ' HA3' ' A' ' 107' ' ' GLY . 7.5 mmm -61.91 -59.83 4.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.212 -0.449 . . . . 1.0800000000000001 111.683 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -64.01 -36.32 83.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.429 -0.35 . . . . 0.25 110.78 -178.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.453 ' HA ' ' HB2' ' A' ' 135' ' ' ASN . 52.1 m -66.9 -39.21 87.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.416 -0.356 . . . . 0.40000000000000002 111.127 177.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.547 ' O ' ' HB2' ' A' ' 137' ' ' HIS . 55.4 t80 -60.31 -43.16 96.6 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.801 -0.444 . . . . 3.1299999999999999 109.801 175.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.54 HD13 ' HB2' ' A' ' 5' ' ' ASN . 5.7 tt -60.34 -50.27 74.29 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.745 -0.835 . . . . 0.94999999999999996 108.745 174.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . 0.516 ' HB3' ' HE3' ' A' ' 1' ' ' MET . 3.8 m-80 -48.98 -58.31 5.1 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.932 -0.576 . . . . 0.46000000000000002 112.443 178.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -80.23 -45.03 18.7 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 0.58999999999999997 112.054 -172.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . 0.547 ' HB2' ' O ' ' A' ' 133' ' ' TYR . 8.2 m80 -91.97 -50.55 5.65 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.361 0.874 . . . . 1.45 113.361 -171.155 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.539 HD21 ' NH2' ' A' ' 99' ' ' ARG . 58.8 mt -91.75 -34.96 14.41 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.607 0.966 . . . . 1.2 113.607 -165.319 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.627 ' O ' ' HG2' ' A' ' 143' ' ' GLN . 31.7 tt0 -51.38 -49.84 79.75 Favored Pre-proline 0 C--N 1.324 -0.526 0 O-C-N 123.313 0.383 . . . . 0.75 111.657 -174.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' A' ' 139' ' ' GLU . 52.8 Cg_exo -52.87 -51.31 11.39 Favored 'Trans proline' 0 C--N 1.36 1.181 0 C-N-CA 121.772 1.648 . . . . 0.56000000000000005 111.624 175.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -54.5 -54.22 43.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.45 -0.795 . . . . 1.2 110.544 178.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.575 HD12 ' HA ' ' A' ' 139' ' ' GLU . 13.6 mt -42.84 -51.84 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.406 -0.815 . . . . 0.32000000000000001 111.961 175.262 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.627 ' HG2' ' O ' ' A' ' 139' ' ' GLU . 14.8 mm-40 -67.07 -30.01 69.94 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.934 -0.576 . . . . 0.56999999999999995 111.747 -176.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 7.0 mm-40 -68.28 -22.28 64.75 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.498 0.666 . . . . 0.78000000000000003 110.7 175.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.642 HD22 ' N ' ' A' ' 145' ' ' ASN . 0.7 OUTLIER -101.72 3.84 40.03 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.28 -0.873 . . . . 0.93000000000000005 108.974 -174.767 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 125.48 -34.02 3.45 Favored Glycine 0 N--CA 1.44 -1.066 0 CA-C-N 114.696 -1.138 . . . . 0.56000000000000005 113.135 173.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . 111.7 162.92 17.18 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 111.1 -0.8 . . . . 0.48999999999999999 111.1 -174.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.659 ' HB3' HG22 ' A' ' 46' ' ' VAL . 39.9 m95 -58.21 -33.59 69.48 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.124 0.787 . . . . 3.5699999999999998 113.124 -172.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.515 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 29.8 m-20 -56.56 -42.87 79.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.852 0.358 . . . . 1.96 110.082 176.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . 0.524 ' O ' ' HG ' ' A' ' 154' ' ' LEU . 25.1 m -60.59 -36.48 78.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.733 -0.667 . . . . 0.67000000000000004 111.721 179.064 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . 0.685 ' CE2' ' HA ' ' A' ' 97' ' ' TRP . 2.2 m-85 -62.81 -39.68 95.04 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.184 0.516 . . . . 3.0 109.641 -177.714 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.621 ' CG1' ' HA ' ' A' ' 46' ' ' VAL . 1.4 m -75.5 -24.44 17.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.859 -0.61 . . . . 1.1499999999999999 110.053 176.114 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 12.8 mm-40 -60.88 -23.46 65.2 Favored 'General case' 0 C--N 1.327 -0.381 0 O-C-N 121.672 -0.642 . . . . 1.6699999999999999 110.478 173.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 150' ' ' THR . 3.6 mt -96.23 -56.04 2.76 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 115.886 -0.597 . . . . 1.3 110.101 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . 0.668 ' OH ' ' HB3' ' A' ' 151' ' ' PHE . 12.0 p90 -121.55 26.51 8.75 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 121.289 0.566 . . . . 4.2400000000000002 112.49 -173.161 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.812 ' HA2' ' HB2' ' A' ' 49' ' ' ALA . . . -61.48 161.4 26.68 Favored Glycine 0 C--N 1.305 -1.185 0 CA-C-N 115.165 -0.925 . . . . 1.1000000000000001 113.442 -178.003 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.581 ' HB2' ' HB3' ' A' ' 48' ' ' GLN . 26.0 t-20 -52.65 109.03 0.36 Allowed 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 114.011 -1.094 . . . . 1.29 111.299 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.75 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 0.6 OUTLIER -98.63 -7.1 28.57 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.755 -0.461 . . . . 2.9900000000000002 109.755 179.243 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -51.6 -35.51 41.82 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.804 -0.635 . . . . 2.52 110.88 176.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -97.66 -35.08 10.69 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.029 -0.532 . . . . 2.8700000000000001 110.689 173.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.75 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -57.24 -66.43 0.46 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.914 -0.585 . . . . 3.2000000000000002 112.068 -175.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . 0.608 ' HA ' ' HB3' ' A' ' 165' ' ' LYS . 6.6 pt-20 -66.65 -23.77 66.2 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 121.069 -0.252 . . . . 3.7200000000000002 111.266 -179.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 22.6 t -65.18 -42.29 93.78 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.607 -0.516 . . . . 4.1799999999999997 109.607 178.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . 0.427 ' O ' ' HG3' ' A' ' 168' ' ' GLU . 29.8 mmt180 -79.42 -33.57 42.49 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-O 121.444 0.64 . . . . 5.8200000000000003 110.285 176.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . 0.608 ' HB3' ' HA ' ' A' ' 162' ' ' GLU . 16.4 ttpp -56.24 -44.77 79.95 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.043 -0.981 . . . . 4.7699999999999996 110.952 177.172 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -63.28 -29.12 73.53 Favored Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.645 -0.788 . . . . 5.0999999999999996 113.02 -175.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -89.97 -12.91 37.33 Favored 'General case' 0 C--N 1.329 -0.326 0 O-C-N 122.464 -0.433 . . . . 5.7199999999999998 111.24 178.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 164' ' ' ARG . 44.2 mt-10 -71.33 -17.97 62.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.13 0.49 . . . . 5.8799999999999999 109.976 172.319 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.525 ' O ' ' HD3' ' A' ' 169' ' ' ARG . 3.6 tmt_? -70.78 -33.44 70.76 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.529 -0.915 . . . . 7.3399999999999999 108.529 177.206 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -105.77 27.19 8.72 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.346 -0.843 . . . . 6.9699999999999998 109.993 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -66.07 94.89 0.26 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.5 -0.773 . . . . 6.9699999999999998 110.066 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -137.51 16.74 2.93 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.476 0.655 . . . . 9.3499999999999996 109.693 -177.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -135.08 -58.13 0.8 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.442 -0.799 . . . . 11.4 109.511 178.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 62.8 22.2 13.25 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.017 -0.992 . . . . 11.52 111.553 178.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . . . . . . . . . 56.3 t-80 -80.15 -30.55 38.93 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.326 -0.62 . . . . 14.48 109.326 175.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -69.41 90.23 0.52 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.647 -0.706 . . . . 15.369999999999999 109.486 177.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -75.53 100.34 4.52 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.061 -0.518 . . . . 16.02 110.69 -177.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 51.6 tp -78.14 -65.52 0.97 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.124 -0.695 . . . . 17.989999999999998 109.124 175.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -177.78 172.02 1.76 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.28 -0.873 . . . . 19.190000000000001 108.8 177.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . . . . . . . . . 18.2 p80 -99.73 150.55 22.19 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.401 -0.52 . . . . 22.260000000000002 109.881 178.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 45.0 m-70 -83.23 171.95 13.09 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.65 -0.5 . . . . 22.510000000000002 109.65 178.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . . . . . . . . . 11.1 p80 -120.64 85.04 2.32 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.593 0.711 . . . . 24.890000000000001 110.867 -178.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . 0.437 ' O ' ' HB2' ' A' ' 184' ' ' HIS . 87.3 m-70 -93.5 -29.24 15.63 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.687 -0.688 . . . . 25.579999999999998 110.634 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.437 ' HB2' ' O ' ' A' ' 183' ' ' HIS . 50.0 m-70 73.75 -30.48 0.21 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.521 0.728 . . . . 27.370000000000001 112.089 -178.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . 0.415 ' H ' ' C ' ' A' ' 183' ' ' HIS . 68.0 m80 . . . . . 0 C--O 1.246 0.882 0 CA-C-O 118.299 -0.857 . . . . 29.059999999999999 110.95 179.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.28 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -116.84 5.93 18.18 Favored Glycine 0 N--CA 1.448 -0.553 0 O-C-N 121.596 -0.69 . . . . 2.9700000000000002 112.12 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.526 ' HB3' ' O2 ' ' B' 1100 ' ' 33B . 24.3 m -128.3 -136.84 0.23 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.637 0.256 . . . . 1.9399999999999999 110.586 -178.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.995 HG23 ' H ' ' B' 1005 ' ' GLY . 4.2 m 43.98 -98.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.218 -0.572 0 CA-C-O 117.281 -1.343 . . . . 1.6299999999999999 111.571 -178.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 1.024 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . -39.34 -25.88 0.06 OUTLIER Glycine 0 CA--C 1.535 1.302 0 CA-C-N 120.188 1.358 . . . . 1.2 114.984 167.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . 0.457 ' HB3' ' H5 ' ' B' 1100 ' ' 33B . 8.2 mpt_? -85.77 -33.83 21.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 117.635 0.717 . . . . 2.8799999999999999 111.636 175.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . 0.53 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -95.15 -55.58 3.02 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.527 0.566 . . . . 1.3100000000000001 112.527 -167.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.671 ' HB2' ' OE2' ' A' ' 89' ' ' GLU . 2.9 mm? -65.89 -44.26 85.8 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.705 -0.48 . . . . 1.3300000000000001 109.705 -175.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 0.965 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -42.93 -44.5 4.61 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 122.474 1.13 . . . . 0.88 110.502 172.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.878 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -79.92 -51.16 9.45 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 113.467 -1.697 . . . . 1.03 111.204 -175.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . 0.568 ' HE2' ' H8 ' ' B' 1100 ' ' 33B . 42.6 m-85 -66.61 -19.84 65.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.152 -0.476 . . . . 1.6699999999999999 110.913 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . 0.908 ' HA2' ' HZ ' ' A' ' 57' ' ' PHE . . . -82.23 -2.6 90.62 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 116.006 -0.543 . . . . 0.78000000000000003 113.033 -178.046 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 39.0 t70 -88.6 7.1 35.0 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.539 0.685 . . . . 1.8999999999999999 109.933 170.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 2.7 m -113.71 91.29 3.59 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.949 -0.568 . . . . 1.4399999999999999 110.158 178.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.483 HD11 ' O ' ' B' 1012 ' ' GLY . 0.8 OUTLIER -132.17 -97.83 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.155 0.502 . . . . 2.9100000000000001 109.965 179.268 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . . . . . . . . . 54.9 t30 -135.16 105.66 6.42 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.242 -0.651 . . . . 4.29 109.242 177.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -98.49 -72.58 0.65 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.735 -0.666 . . . . 8.1699999999999999 111.154 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.57 0 O-C-N 122.271 -0.268 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.878 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.8 tpt . . . . . 0 N--CA 1.484 1.24 0 CA-C-O 120.83 0.348 . . . . 6.21 110.653 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.9 m -160.67 -51.06 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.001 -0.545 . . . . 1.8700000000000001 110.585 -179.885 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.413 ' O ' ' HB3' ' A' ' 6' ' ' ARG . 2.0 mp0 -72.54 -10.26 59.58 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.364 -0.38 . . . . 2.4199999999999999 111.091 179.916 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.2 p -63.96 -37.19 86.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.477 -0.329 . . . . 1.25 111.137 -179.791 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.622 ' HA ' HD13 ' A' ' 8' ' ' LEU . 23.9 p30 -64.65 -17.11 63.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.684 0.278 . . . . 1.78 110.869 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.519 ' NH1' ' HA ' ' A' ' 128' ' ' ALA . 9.9 tpp180 -60.22 -39.7 87.56 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.056 0.455 . . . . 1.3999999999999999 109.85 178.999 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -64.41 -42.54 96.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.625 -0.716 . . . . 0.68000000000000005 110.423 179.579 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.622 HD13 ' HA ' ' A' ' 5' ' ' ASN . 8.9 mp -54.36 -39.56 67.25 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.812 -0.631 . . . . 1.1599999999999999 110.401 179.821 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.422 HG13 ' HE2' ' A' ' 130' ' ' MET . 91.6 t -73.37 -64.8 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.927 -0.579 . . . . 0.27000000000000002 110.086 178.98 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.418 HG21 ' OE2' ' A' ' 31' ' ' GLU . 52.4 t -44.8 -66.77 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.254 -0.884 . . . . 0.33000000000000002 112.178 -179.969 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -43.32 -33.58 1.03 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.58999999999999997 112.137 -179.226 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.44 ' CE1' ' HA ' ' A' ' 105' ' ' SER . 2.2 t80 -77.33 -46.68 22.15 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.107 -0.237 . . . . 1.6100000000000001 111.221 -179.556 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.654 ' HG ' ' HA2' ' A' ' 108' ' ' GLY . 10.0 mp -60.45 -37.51 81.2 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.948 0.404 . . . . 0.34000000000000002 110.525 179.536 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.46 ' HA ' ' HB2' ' A' ' 24' ' ' TRP . 38.3 t -68.13 -42.51 80.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.873 -0.603 . . . . 1.05 110.195 179.635 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -68.9 -24.28 64.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.713 -0.676 . . . . 1.22 110.442 179.596 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.541 ' HG3' HG21 ' A' ' 112' ' ' VAL . 1.9 tppt? -85.34 -16.52 39.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.942 -0.572 . . . . 1.4099999999999999 110.775 -179.761 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 mp -90.04 -13.92 34.94 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.072 -0.513 . . . . 1.3500000000000001 110.116 179.263 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 72.6 m -75.27 -35.88 61.29 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.788 -0.642 . . . . 0.93999999999999995 110.728 179.702 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -70.55 -4.84 25.04 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.318 -0.401 . . . . 1.3700000000000001 110.473 179.769 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.462 ' HG3' HG13 ' A' ' 112' ' ' VAL . 29.7 mmmt -109.51 -26.04 10.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.849 -0.614 . . . . 2.2000000000000002 110.775 -179.845 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.03 4.29 44.88 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.841 -0.695 . . . . 0.53000000000000003 111.98 -179.402 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 90.4 m-85 -102.1 160.9 14.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.854 0.359 . . . . 0.76000000000000001 110.855 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.1 t -110.79 138.73 46.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.063 -0.517 . . . . 0.52000000000000002 110.573 179.757 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.46 ' HB2' ' HA ' ' A' ' 14' ' ' SER . 11.6 t90 -68.01 -45.36 74.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.066 -0.516 . . . . 3.3599999999999999 111.085 -179.934 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.463 ' HA ' ' OG ' ' A' ' 28' ' ' SER . 50.9 m -56.96 -41.68 78.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 1.3700000000000001 111.834 -179.369 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -56.59 -24.02 44.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.298 -0.41 . . . . 1.1100000000000001 112.044 -179.227 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.402 ' CG ' ' HB3' ' A' ' 120' ' ' GLN . 29.1 m-85 -126.7 16.0 7.52 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.878 0.325 . . . . 1.28 111.878 -179.08 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.539 ' HA ' ' HB2' ' A' ' 124' ' ' SER . 83.6 p -99.9 -179.99 4.34 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.12 0.486 . . . . 1.8100000000000001 111.413 -179.792 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.465 ' HA ' ' HB3' ' A' ' 32' ' ' GLU . 9.7 t70 -166.07 -15.34 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.394 -0.821 . . . . 2.3100000000000001 109.868 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.701 HG23 ' H ' ' A' ' 31' ' ' GLU . 0.6 OUTLIER -58.58 -75.99 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.319 -0.855 . . . . 0.92000000000000004 111.809 -179.833 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.701 ' H ' HG23 ' A' ' 30' ' ' VAL . 42.8 mt-10 -87.5 -3.43 59.0 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.927 0.394 . . . . 2.7400000000000002 110.682 179.987 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.465 ' HB3' ' HA ' ' A' ' 29' ' ' ASP . 38.7 tt0 -67.96 -46.63 70.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.836 -0.62 . . . . 1.45 111.367 -179.627 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -93.39 -57.95 2.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.315 -0.402 . . . . 1.8700000000000001 111.553 -179.432 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 18.0 ptt180 -100.42 156.37 17.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.919 0.39 . . . . 3.3900000000000001 111.283 -179.691 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 68.0 p -118.63 93.28 4.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.87 -0.605 . . . . 2.25 110.737 179.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -74.08 -85.64 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.949 -0.569 . . . . 3.3399999999999999 111.47 -179.629 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -88.01 158.52 49.94 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.805 -0.634 . . . . 1.9199999999999999 111.319 -179.358 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.509 ' HG2' ' HB ' ' A' ' 41' ' ' THR . 39.1 Cg_exo -61.14 -176.15 0.15 Allowed 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.335 2.023 . . . . 1.8700000000000001 111.846 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -75.52 -18.44 59.8 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.05 -0.523 . . . . 4.6399999999999997 110.978 -179.971 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 170.06 55.13 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.474 -0.87 . . . . 2.1499999999999999 113.024 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.607 HG23 ' H ' ' A' ' 42' ' ' GLU . 0.7 OUTLIER -56.62 -59.17 5.39 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.95 0.405 . . . . 1.1200000000000001 110.491 179.273 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.607 ' H ' HG23 ' A' ' 41' ' ' THR . 12.2 pt-20 -124.07 -19.6 5.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.423 0.63 . . . . 2.02 109.377 179.084 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.739 ' HA ' HG22 ' A' ' 46' ' ' VAL . 27.1 m -72.77 -23.34 60.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.918 -1.037 . . . . 1.25 112.409 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -52.28 -36.36 52.59 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.094 0.405 . . . . 1.9099999999999999 112.094 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.452 ' HB1' HG21 ' A' ' 152' ' ' VAL . . . -91.81 -36.17 13.68 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.172 0.434 . . . . 0.52000000000000002 112.172 -179.024 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.739 HG22 ' HA ' ' A' ' 43' ' ' SER . 1.5 m -75.27 -28.12 20.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 111.876 0.324 . . . . 1.4099999999999999 111.876 -178.76 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.6 ptmt -77.94 -34.21 51.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.887 0.375 . . . . 0.67000000000000004 110.121 -179.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.507 HE21 ' ND2' ' A' ' 157' ' ' ASN . 11.0 mm100 -68.61 -36.32 78.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.861 -0.609 . . . . 0.98999999999999999 109.423 178.745 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.445 ' HB2' HG23 ' A' ' 152' ' ' VAL . . . -77.59 -31.7 53.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.532 -0.758 . . . . 0.41999999999999998 109.47 178.544 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.566 HD21 ' CD2' ' A' ' 104' ' ' PHE . 28.9 tp -67.41 -31.65 72.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.972 -1.013 . . . . 1.3300000000000001 110.082 179.39 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -70.06 -40.45 75.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.263 -0.881 . . . . 2.1699999999999999 110.543 179.6 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.9 -45.97 69.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.927 -0.579 . . . . 1.1000000000000001 110.707 179.847 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.99 -36.54 83.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.04 -0.527 . . . . 0.53000000000000003 110.925 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.442 ' O ' ' HG3' ' A' ' 58' ' ' GLU . . . -72.0 -37.88 60.14 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.811 -0.709 . . . . 0.69999999999999996 112.395 -179.985 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -55.35 -43.81 75.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.69 0.281 . . . . 1.04 111.386 -179.798 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -72.65 -16.68 61.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.335 -0.393 . . . . 2.29 111.49 -179.602 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -90.33 -31.46 16.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.578 -0.283 . . . . 2.29 111.26 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.442 ' HG3' ' O ' ' A' ' 54' ' ' GLY . 49.2 mt-10 -63.84 -60.79 2.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.428 -0.351 . . . . 1.3 111.549 -179.523 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.469 HD12 ' N ' ' A' ' 60' ' ' ARG . 3.8 pp -54.97 -20.42 9.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.055 -0.521 . . . . 1.54 111.758 -179.347 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.469 ' N ' HD12 ' A' ' 59' ' ' LEU . 23.4 ttm180 -66.66 -38.5 86.97 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.2 0.445 . . . . 2.5800000000000001 112.2 -178.818 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 16.3 p90 -129.63 15.15 5.97 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.133 -0.227 . . . . 5.3200000000000003 111.449 -179.389 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.408 ' HA ' ' HB3' ' A' ' 65' ' ' PHE . 29.3 ttm180 -50.49 -47.0 57.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.501 -0.318 . . . . 4.4800000000000004 111.642 -179.685 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.08 -32.33 54.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.171 -0.468 . . . . 4.7199999999999998 111.61 -179.2 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.421 ' O ' HD13 ' A' ' 68' ' ' LEU . . . -91.22 -26.51 18.99 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.909 0.385 . . . . 1.1699999999999999 111.083 179.903 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.534 ' CE1' ' HB1' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -58.31 -39.25 78.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.944 -0.571 . . . . 2.8100000000000001 111.635 -179.33 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 69.6 m -76.5 -25.7 54.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.798 0.332 . . . . 2.1899999999999999 111.16 -179.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -93.7 -12.33 29.51 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.155 -0.475 . . . . 2.7200000000000002 111.045 -179.463 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.433 ' HG ' HE21 ' A' ' 71' ' ' GLN . 2.2 mp -80.91 -9.04 59.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.181 -0.463 . . . . 1.5600000000000001 111.143 -179.491 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.433 HG22 ' OE1' ' A' ' 113' ' ' GLU . 46.0 p -59.8 -31.03 69.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.305 -0.407 . . . . 0.69999999999999996 110.874 179.765 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -77.01 -36.88 55.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.962 -0.563 . . . . 1.3400000000000001 110.74 179.842 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.433 HE21 ' HG ' ' A' ' 68' ' ' LEU . 17.2 mt-30 -74.53 -23.62 58.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.155 -0.475 . . . . 1.4199999999999999 110.534 179.78 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.457 HD11 ' HZ ' ' A' ' 106' ' ' PHE . 44.7 mt -92.87 -18.22 23.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.811 -0.632 . . . . 1.3700000000000001 110.989 -179.903 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 m80 55.69 49.46 16.3 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 110.117 -0.327 . . . . 2.7200000000000002 110.117 -179.081 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.535 HG13 ' HB3' ' A' ' 113' ' ' GLU . 37.8 mm -49.56 93.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 115.991 -0.549 . . . . 0.91000000000000003 110.968 -179.755 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.556 ' O ' ' HB2' ' A' ' 79' ' ' ALA . 0.4 OUTLIER -130.94 164.6 40.96 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-N 115.478 -0.783 . . . . 0.51000000000000001 110.028 -179.368 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.515 ' HD2' ' OG1' ' A' ' 75' ' ' THR . 12.4 Cg_endo -55.62 142.07 82.58 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.191 1.928 . . . . 0.46999999999999997 113.61 -179.234 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.702 ' H ' HD11 ' A' ' 122' ' ' LEU . . . 63.92 -77.56 0.05 OUTLIER Glycine 0 CA--C 1.52 0.401 0 CA-C-N 115.464 -0.789 . . . . 0.40000000000000002 114.828 178.17 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.469 HG22 ' NE2' ' A' ' 81' ' ' GLN . 58.9 p -55.05 -4.83 0.08 Allowed 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 113.652 0.982 . . . . 0.56000000000000005 113.652 -177.931 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.556 ' HB2' ' O ' ' A' ' 75' ' ' THR . . . -60.11 -24.8 64.95 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 121.483 0.659 . . . . 0.34000000000000002 109.233 178.447 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -69.1 -32.83 72.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.83 -1.077 . . . . 4.1299999999999999 110.091 179.242 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.469 ' NE2' HG22 ' A' ' 78' ' ' THR . 46.9 mt-30 -72.48 -25.47 61.44 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.269 0.557 . . . . 1.03 109.623 178.532 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 5.3 m -75.73 -40.44 55.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.442 -0.799 . . . . 0.47999999999999998 108.9 178.548 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -74.89 -14.59 60.68 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 114.921 -1.036 . . . . 1.1799999999999999 109.044 178.505 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.609 ' HA ' HG12 ' A' ' 87' ' ' VAL . 40.4 tt0 -67.77 -42.3 81.92 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.28 -0.873 . . . . 0.80000000000000004 110.39 179.463 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -60.36 -25.62 65.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.034 -0.53 . . . . 1.6200000000000001 110.618 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.408 HG21 ' CE2' ' A' ' 106' ' ' PHE . 41.4 t -87.31 -50.09 14.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.833 -0.621 . . . . 1.3 111.401 -179.468 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.609 HG12 ' HA ' ' A' ' 84' ' ' GLU . 9.2 p -63.69 -26.85 41.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.444 -0.344 . . . . 0.84999999999999998 111.107 -179.719 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -67.14 -39.14 86.52 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.987 0.422 . . . . 0.91000000000000003 110.535 179.632 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.699 ' HA ' ' HD2' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -89.93 -4.18 57.64 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.884 -0.598 . . . . 2.8700000000000001 110.532 179.571 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.723 HD12 HH11 ' A' ' 99' ' ' ARG . 3.7 tp -93.59 9.21 37.76 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.736 -0.666 . . . . 1.28 111.291 -179.295 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.561 ' HA ' HG22 ' A' ' 95' ' ' VAL . 2.8 p90 -144.44 -28.66 0.49 Allowed 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.692 -0.403 . . . . 2.2999999999999998 111.937 -179.992 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.699 ' HD2' ' HA ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -77.8 -22.88 49.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.73 0.3 . . . . 5.0599999999999996 110.971 -179.514 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.428 ' N ' ' HD3' ' A' ' 92' ' ' ARG . 19.9 t70 -88.92 2.49 53.72 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.285 -0.416 . . . . 3.1200000000000001 110.62 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 113.66 109.91 2.91 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.855 -0.688 . . . . 2.3100000000000001 112.389 -179.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.561 HG22 ' HA ' ' A' ' 91' ' ' PHE . 42.2 t -79.16 90.22 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.862 0.363 . . . . 1.0600000000000001 111.01 179.99 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.635 ' N ' HD22 ' A' ' 96' ' ' ASN . 0.7 OUTLIER -89.48 178.34 6.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.048 -0.524 . . . . 2.1200000000000001 110.348 179.653 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 22.1 m-90 -60.55 -60.57 3.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.032 0.444 . . . . 3.3399999999999999 110.146 179.121 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.618 ' O ' HG22 ' A' ' 101' ' ' VAL . . . -64.45 -26.19 70.58 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.618 -0.719 . . . . 0.68999999999999995 111.996 179.587 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.723 HH11 HD12 ' A' ' 90' ' ' LEU . 13.5 tpp180 -56.06 -36.04 67.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.21 0.528 . . . . 4.2400000000000002 110.162 179.376 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.569 HG23 HD23 ' A' ' 138' ' ' LEU . 37.9 mt -71.99 -37.67 61.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.445 -0.798 . . . . 0.44 111.198 -179.775 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 98' ' ' GLY . 1.0 OUTLIER -63.23 -29.8 48.15 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.03 0.443 . . . . 1.3500000000000001 109.958 179.616 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -68.19 -28.98 67.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.705 -0.68 . . . . 0.44 109.509 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.503 ' HB2' HD23 ' A' ' 90' ' ' LEU . 86.3 t80 -72.06 -22.27 61.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.97 -1.014 . . . . 1.49 110.207 179.455 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.566 ' CD2' HD21 ' A' ' 50' ' ' LEU . 72.2 m-85 -90.86 -46.02 8.45 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.773 -0.649 . . . . 3.29 111.201 179.765 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.44 ' HA ' ' CE1' ' A' ' 12' ' ' PHE . 19.7 p -62.01 -40.65 96.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.937 -0.574 . . . . 1.1899999999999999 110.665 -179.954 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.457 ' HZ ' HD11 ' A' ' 72' ' ' LEU . 15.9 t80 -80.25 -41.91 24.19 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.18 -0.463 . . . . 2.8900000000000001 110.591 179.864 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.91 -43.76 98.95 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.451 -0.88 . . . . 0.29999999999999999 111.12 178.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.654 ' HA2' ' HG ' ' A' ' 13' ' ' LEU . . . -70.67 -28.65 70.57 Favored Glycine 0 N--CA 1.447 -0.601 0 N-CA-C 110.591 -1.004 . . . . 0.23000000000000001 110.591 178.449 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.534 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -70.55 -30.84 67.67 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 109.256 -0.646 . . . . 0.31 109.256 178.338 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.506 ' HB3' HD13 ' A' ' 126' ' ' ILE . 0.2 OUTLIER -65.3 -33.74 76.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.446 -0.797 . . . . 1.1200000000000001 108.896 178.851 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.504 ' SG ' HG13 ' A' ' 123' ' ' VAL . 3.2 t -68.12 -38.49 82.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.184 -0.916 . . . . 0.26000000000000001 109.955 178.906 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.541 HG21 ' HG3' ' A' ' 16' ' ' LYS . 74.7 t -70.1 -39.23 76.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.725 -0.67 . . . . 0.34999999999999998 110.534 179.339 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.535 ' HB3' HG13 ' A' ' 74' ' ' ILE . 31.0 mt-10 -67.65 -21.15 65.38 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.038 -0.528 . . . . 2.5099999999999998 109.948 179.454 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.469 ' HB3' ' HB2' ' A' ' 122' ' ' LEU . 74.9 m -77.23 -50.16 13.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.677 -0.692 . . . . 0.28000000000000003 109.867 179.07 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.536 HG23 ' HG3' ' A' ' 120' ' ' GLN . 3.4 p -66.65 -21.82 29.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-N 116.059 -0.519 . . . . 1.23 109.983 179.001 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -63.63 -37.85 88.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.64 -0.709 . . . . 0.59999999999999998 110.492 179.477 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 53.6 mmtt -93.69 22.29 5.64 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.992 -0.549 . . . . 1.6200000000000001 110.716 179.898 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 67.77 22.32 8.9 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.205 -0.452 . . . . 1.8799999999999999 110.936 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.495 ' SD ' ' HD3' ' A' ' 76' ' ' PRO . 10.4 mtm -114.77 78.01 1.12 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.251 -0.431 . . . . 0.31 110.506 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.536 ' HG3' HG23 ' A' ' 115' ' ' VAL . 13.9 mp0 -84.59 -3.5 58.49 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.474 -0.33 . . . . 1.1499999999999999 111.668 -179.219 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.691 HG23 HD22 ' A' ' 122' ' ' LEU . 25.4 m -72.61 -5.91 7.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.855 0.36 . . . . 0.46000000000000002 110.914 179.87 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.702 HD11 ' H ' ' A' ' 77' ' ' GLY . 4.1 mm? -93.09 -16.87 24.48 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.043 -0.526 . . . . 0.26000000000000001 110.063 179.123 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.504 HG13 ' SG ' ' A' ' 111' ' ' CYS . 94.3 t -52.72 -59.08 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.786 -0.643 . . . . 0.25 111.074 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . 0.539 ' HB2' ' HA ' ' A' ' 28' ' ' SER . 37.5 t -65.83 -36.76 84.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.032 -0.531 . . . . 1.3500000000000001 111.449 -179.692 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.619 ' HD2' HD13 ' A' ' 122' ' ' LEU . 94.4 mtt180 -60.74 -67.12 0.43 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.507 -0.315 . . . . 2.6699999999999999 111.248 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.506 HD13 ' HB3' ' A' ' 110' ' ' LEU . 74.6 mt -44.82 -42.68 2.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.044 -0.525 . . . . 0.23000000000000001 111.489 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.587 ' HB2' HD22 ' A' ' 13' ' ' LEU . . . -56.62 -42.52 78.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.416 -0.357 . . . . 0.28999999999999998 111.057 179.855 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.519 ' HA ' ' NH1' ' A' ' 6' ' ' ARG . . . -69.13 -41.47 77.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.031 -0.531 . . . . 0.28000000000000003 111.376 -179.963 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -64.31 -39.36 93.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.325 -0.398 . . . . 3.9100000000000001 111.32 -179.778 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.422 ' HE2' HG13 ' A' ' 9' ' ' VAL . 89.2 mtp -65.16 -52.83 52.65 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.19 -0.459 . . . . 1.0800000000000001 111.083 -179.574 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -57.8 -53.91 52.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.277 -0.419 . . . . 0.25 110.749 179.788 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 90.8 m -54.22 -49.73 68.76 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.052 -0.522 . . . . 0.40000000000000002 111.066 179.869 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -57.03 -30.78 64.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.151 0.5 . . . . 3.1299999999999999 110.052 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.619 ' O ' HD23 ' A' ' 134' ' ' LEU . 3.6 tt -81.28 -23.2 38.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.55 -0.75 . . . . 0.94999999999999996 110.119 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 135' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -83.06 -6.91 59.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 0.46000000000000002 112.06 -179.525 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -126.99 -30.47 2.71 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.126 0.787 . . . . 0.58999999999999997 113.126 -178.148 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 8.3 m80 -107.54 -52.36 2.77 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.29 0.848 . . . . 1.45 113.29 -178.124 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.569 HD23 HG23 ' A' ' 100' ' ' ILE . 10.1 mp -80.84 -37.24 30.33 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.858 1.059 . . . . 1.2 113.858 -177.102 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.453 ' N ' ' HD2' ' A' ' 140' ' ' PRO . 34.8 tt0 -48.73 -53.84 32.88 Favored Pre-proline 0 N--CA 1.468 0.453 0 N-CA-C 112.407 0.521 . . . . 0.75 112.407 -178.073 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . 0.463 ' O ' ' HG2' ' A' ' 144' ' ' GLU . 37.2 Cg_endo -65.6 -28.58 52.81 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 121.733 1.622 . . . . 0.56000000000000005 112.272 -179.623 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . 0.444 ' CD1' ' HB ' ' A' ' 95' ' ' VAL . 1.2 t-105 -78.57 -30.01 46.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 1.2 111.155 -179.612 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.681 HG22 ' HA2' ' A' ' 147' ' ' GLY . 60.5 mt -69.83 -40.22 78.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.969 -0.559 . . . . 0.32000000000000001 110.656 -179.706 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 79.0 mm-40 -63.08 -28.68 70.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.057 -0.519 . . . . 0.56999999999999995 110.114 179.322 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 140' ' ' PRO . 16.5 mm-40 -69.62 -23.8 63.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.847 -0.615 . . . . 0.78000000000000003 110.235 179.301 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.566 ' N ' HD22 ' A' ' 145' ' ' ASN . 0.8 OUTLIER -97.51 -1.37 44.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.712 -0.676 . . . . 0.93000000000000005 110.718 -179.994 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 146' ' ' GLY . . . . . . . . . . . . . . . 120.14 -35.91 3.61 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.869 -0.682 . . . . 0.56000000000000005 112.812 179.758 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.681 ' HA2' HG22 ' A' ' 142' ' ' ILE . . . 117.15 167.31 14.39 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.806 -0.711 . . . . 0.48999999999999999 112.155 -179.741 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 148' ' ' TRP . . . . . 0.562 ' NE1' HD13 ' A' ' 142' ' ' ILE . 10.7 m-90 -57.76 -38.24 75.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.061 0.458 . . . . 3.5699999999999998 110.176 179.459 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.445 ' O ' ' HG2' ' A' ' 153' ' ' GLU . 32.5 t70 -60.34 -27.38 67.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.634 -0.712 . . . . 1.96 110.449 179.867 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 150' ' ' THR . . . . . . . . . . . . . 25.2 m -83.37 -25.38 31.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.273 0.558 . . . . 0.67000000000000004 109.912 178.996 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 151' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -68.48 -35.2 77.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.481 -0.781 . . . . 3.0 110.383 179.547 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.452 HG21 ' HB1' ' A' ' 45' ' ' ALA . 12.2 p -78.79 -2.17 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.436 0.636 . . . . 1.1499999999999999 110.114 179.265 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 15.8 mm-40 -91.69 -18.02 24.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.809 -0.632 . . . . 1.6699999999999999 109.7 178.657 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 22.7 mt -106.58 -52.88 2.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.488 -0.778 . . . . 1.3 110.393 179.714 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 155' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -109.0 27.82 9.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.577 -0.738 . . . . 4.2400000000000002 110.943 -179.824 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 156' ' ' GLY . . . . . 0.439 ' HA2' HG23 ' A' ' 152' ' ' VAL . . . -46.78 152.46 1.32 Allowed Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.909 -0.587 . . . . 1.1000000000000001 113.683 -179.324 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.507 ' ND2' HE21 ' A' ' 48' ' ' GLN . 21.5 t-20 -60.69 116.72 4.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.624 -0.288 . . . . 1.29 110.661 179.719 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 158' ' ' ASN . . . . . 0.568 ' HA ' ' HB3' ' A' ' 161' ' ' ALA . 8.8 m120 -69.99 -24.82 63.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.334 -0.394 . . . . 2.9900000000000002 111.701 -179.629 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.485 ' HB3' ' OD1' ' A' ' 157' ' ' ASN . . . -59.86 -26.06 65.54 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.014 0.435 . . . . 2.52 110.295 179.474 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -105.05 -34.16 8.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.757 -0.656 . . . . 2.8700000000000001 110.396 179.297 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 161' ' ' ALA . . . . . 0.568 ' HB3' ' HA ' ' A' ' 158' ' ' ASN . . . -61.17 -44.18 97.71 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.998 -0.546 . . . . 3.2000000000000002 110.022 179.239 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -69.6 -34.73 74.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.569 -0.742 . . . . 3.7200000000000002 109.659 178.966 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 163' ' ' SER . . . . . . . . . . . . . 46.8 t -59.82 -40.25 87.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.836 -0.62 . . . . 4.1799999999999997 109.486 178.967 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 164' ' ' ARG . . . . . 0.433 ' O ' ' HG3' ' A' ' 168' ' ' GLU . 8.1 mpt_? -77.57 -30.97 52.88 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.566 -0.743 . . . . 5.8200000000000003 109.683 178.697 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -70.24 -27.9 64.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.636 -0.711 . . . . 4.7699999999999996 109.874 179.39 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 166' ' ' GLY . . . . . 0.485 ' O ' ' HB2' ' A' ' 169' ' ' ARG . . . -64.48 -53.99 32.1 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.573 -0.74 . . . . 5.0999999999999996 111.5 179.568 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -63.33 -17.79 62.94 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.047 -0.723 . . . . 5.7199999999999998 109.047 178.597 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.55 ' HG2' ' HA ' ' A' ' 173' ' ' HIS . 39.4 mt-10 -88.82 42.34 1.07 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.173 -0.921 . . . . 5.8799999999999999 109.938 178.861 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.485 ' HB2' ' O ' ' A' ' 166' ' ' GLY . 0.0 OUTLIER -127.73 -70.59 0.69 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.403 -0.817 . . . . 7.3399999999999999 109.727 179.105 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.538 ' C ' ' H ' ' A' ' 172' ' ' HIS . 3.2 mm? -66.79 -61.31 2.02 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 109.226 -0.657 . . . . 6.9699999999999998 109.226 178.959 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.45 -0.56 2.8 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 107.89 -1.152 . . . . 6.9699999999999998 107.89 177.495 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 172' ' ' HIS . . . . . 0.538 ' H ' ' C ' ' A' ' 170' ' ' LEU . 0.4 OUTLIER 76.81 -62.84 0.4 Allowed 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 114.323 -1.308 . . . . 9.3499999999999996 110.517 179.384 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 173' ' ' HIS . . . . . 0.584 ' ND1' ' HB3' ' A' ' 175' ' ' HIS . 0.6 OUTLIER 162.83 -153.13 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.477 -1.305 . . . . 11.4 107.477 179.598 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 174' ' ' HIS . . . . . 0.644 ' HE2' ' HB3' ' A' ' 180' ' ' HIS . 0.3 OUTLIER -48.46 -16.64 0.11 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.266 -0.642 . . . . 11.52 109.266 178.351 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 175' ' ' HIS . . . . . 0.643 ' HB2' ' H ' ' A' ' 180' ' ' HIS . 0.0 OUTLIER -38.25 -27.26 0.02 OUTLIER 'General case' 0 C--O 1.212 -0.875 0 CA-C-N 115.256 -0.884 . . . . 14.48 111.598 178.525 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 176' ' ' HIS . . . . . 0.628 ' ND1' ' N ' ' A' ' 177' ' ' HIS . 15.0 p80 -35.79 -41.01 0.2 Allowed 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 108.914 -0.773 . . . . 15.369999999999999 108.914 179.157 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 177' ' ' HIS . . . . . 0.628 ' N ' ' ND1' ' A' ' 176' ' ' HIS . 0.1 OUTLIER -81.61 45.2 0.86 Allowed 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 107.53 -1.285 . . . . 16.02 107.53 177.843 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.626 ' HB3' ' ND1' ' A' ' 183' ' ' HIS . 0.9 OUTLIER 71.94 130.84 0.04 OUTLIER 'General case' 0 N--CA 1.44 -0.952 0 N-CA-C 108.3 -1.0 . . . . 17.989999999999998 108.3 -176.577 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 179' ' ' GLU . . . . . 0.734 ' HB2' ' HE2' ' A' ' 183' ' ' HIS . 0.3 OUTLIER -13.5 120.3 0.01 OUTLIER 'General case' 0 CA--C 1.508 -0.662 0 O-C-N 124.09 0.869 . . . . 19.190000000000001 111.799 -179.064 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 180' ' ' HIS . . . . . 0.644 ' HB3' ' HE2' ' A' ' 174' ' ' HIS . 0.0 OUTLIER 7.09 -59.78 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.461 0 O-C-N 125.224 1.577 . . . . 22.260000000000002 114.028 179.968 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . 0.708 ' N ' ' O ' ' A' ' 179' ' ' GLU . 12.0 m-70 -130.37 -32.76 1.74 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.855 -0.611 . . . . 22.510000000000002 110.256 -179.285 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 182' ' ' HIS . . . . . 0.625 ' HB2' ' HB3' ' A' ' 179' ' ' GLU . 0.7 OUTLIER -61.88 141.76 57.78 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.016 -0.993 . . . . 24.890000000000001 109.447 -179.934 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 183' ' ' HIS . . . . . 0.734 ' HE2' ' HB2' ' A' ' 179' ' ' GLU . 5.8 p80 44.16 14.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 O-C-N 124.064 0.853 . . . . 25.579999999999998 110.284 -177.216 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 184' ' ' HIS . . . . . 0.562 ' H ' ' C ' ' A' ' 182' ' ' HIS . 8.4 t-80 -116.28 161.14 19.45 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 114.614 -1.175 . . . . 27.370000000000001 108.065 179.818 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . 0.533 ' NE2' ' HB3' ' A' ' 181' ' ' HIS . 1.3 p-80 . . . . . 0 C--O 1.247 0.929 0 O-C-N 124.203 0.939 . . . . 29.059999999999999 111.654 179.51 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1001 ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.092 . . . . . . . . 4.0499999999999998 . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B 1002 ' ' GLY . . . . . . . . . . . . . . . -94.66 2.22 66.92 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.694 -0.765 . . . . 2.9700000000000002 112.625 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1003 ' ' CYS . . . . . 0.519 ' O ' ' N ' ' B' 1005 ' ' GLY . 72.8 m -94.42 -142.91 0.24 Allowed 'General case' 0 C--N 1.328 -0.34 0 O-C-N 122.877 -0.19 . . . . 1.9399999999999999 110.972 -179.829 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B 1004 ' ' VAL . . . . . 0.67 HG23 ' H ' ' B' 1005 ' ' GLY . 1.7 m 43.22 -80.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 C-N-CA 123.307 0.643 . . . . 1.6299999999999999 112.298 -179.63 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B 1005 ' ' GLY . . . . . 0.684 ' HA2' ' HG2' ' A' ' 89' ' ' GLU . . . -48.6 -23.02 2.98 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 121.002 -0.618 . . . . 1.2 112.858 179.593 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B 1006 ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -110.11 -40.61 4.67 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.835 0.35 . . . . 2.8799999999999999 111.188 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1007 ' ' ALA . . . . . 0.491 ' HB2' ' O2 ' ' B' 1100 ' ' 33B . . . -56.95 -76.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.008 -0.542 . . . . 1.3100000000000001 112.22 -179.197 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B 1008 ' ' LEU . . . . . 0.546 ' H ' HD22 ' B' 1008 ' ' LEU . 3.3 mm? -50.99 -35.2 32.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 1.3300000000000001 111.846 -178.875 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B 1009 ' ' ALA . . . . . 0.624 ' HB2' ' HB2' ' A' ' 89' ' ' GLU . . . -62.8 -38.87 92.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.121 0.486 . . . . 0.88 110.977 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B 1010 ' ' ALA . . . . . 0.668 ' HB1' ' C13' ' B' 1100 ' ' 33B . . . -79.95 -52.64 7.59 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.577 -0.738 . . . . 1.03 111.704 -179.306 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B 1011 ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -60.31 -25.42 65.76 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.805 0.336 . . . . 1.6699999999999999 110.763 179.61 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1012 ' ' GLY . . . . . . . . . . . . . . . -74.88 9.15 12.01 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 121.007 -0.616 . . . . 0.78000000000000003 112.787 -179.829 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1013 ' ' ASP . . . . . . . . . . . . . 20.7 t70 -105.16 -5.15 20.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.988 0.423 . . . . 1.8999999999999999 110.405 179.748 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1014 ' ' CYS . . . . . . . . . . . . . 5.1 m -97.7 -1.14 44.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.862 -0.608 . . . . 1.4399999999999999 111.239 -179.585 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B 1015 ' ' ILE . . . . . 0.561 ' HB ' ' HA3' ' A' ' 98' ' ' GLY . 1.6 pp -64.36 -11.35 10.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 112.209 0.448 . . . . 2.9100000000000001 112.209 -179.399 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B 1016 ' ' ASN . . . . . 0.563 ' HB3' ' NH1' ' B' 1017 ' ' ARG . 6.2 t-20 -59.05 -68.48 0.27 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.675 0.274 . . . . 4.29 110.456 -179.737 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B 1017 ' ' ARG . . . . . 0.563 ' NH1' ' HB3' ' B' 1016 ' ' ASN . 0.0 OUTLIER -177.25 -163.73 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.371 -0.377 . . . . 8.1699999999999999 110.868 179.325 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B 1018 ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.664 -0.244 . . . . 4.96 . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B 1100 ' ' 33B . . . . . 0.668 ' C13' ' HB1' ' B' 1010 ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_